data_r9bkpsf
# 
_audit.revision_id     1_0 
_audit.creation_date   2024-06-05 
_audit.update_record   "Initial release" 
# 
_cell.entry_id      9bkp 
_cell.length_a      33.867 
_cell.length_b      34.594 
_cell.length_c      43.301 
_cell.angle_alpha   90.000 
_cell.angle_beta    90.000 
_cell.angle_gamma   90.000 
# 
_diffrn_radiation_wavelength.id           1 
_diffrn_radiation_wavelength.wavelength   1 
# 
_entry.id   9bkp 
# 
_exptl_crystal.id   1 
# 
_reflns_scale.group_code   1 
# 
_symmetry.entry_id               9bkp 
_symmetry.space_group_name_H-M   "P 21 21 21" 
_symmetry.Int_Tables_number      19 
# 
loop_
_refln.crystal_id 
_refln.wavelength_id 
_refln.scale_group_code 
_refln.index_h 
_refln.index_k 
_refln.index_l 
_refln.status 
_refln.pdbx_r_free_flag 
_refln.F_meas_au 
_refln.F_meas_sigma_au 
_refln.pdbx_HL_A_iso 
_refln.pdbx_HL_B_iso 
_refln.pdbx_HL_C_iso 
_refln.pdbx_HL_D_iso 
_refln.pdbx_FWT 
_refln.pdbx_PHWT 
_refln.pdbx_DELFWT 
_refln.pdbx_DELPHWT 
1 1 1 0  0  2  o 0 10.2029  0.111488  0.0309297    0            0            0            1.23823    0            1.91104   0            
1 1 1 0  0  4  o 0 116.772  0.927759  -0.723741    8.86327e-17  0            0            513.131    180          53.1117   -180         
1 1 1 0  0  6  o 0 82.1097  0.934384  -0.45994     5.63264e-17  0            0            359.1      0            90.1851   0            
1 1 1 0  0  8  o 0 69.7338  0.802373  -0.19992     2.44831e-17  0            0            293.958    180          44.5856   -0           
1 1 1 0  0  10 f 1 75.7635  0.889017  0.21072      0            0            0            316.659    180          153.02    -180         
1 1 1 0  0  12 o 0 10.7517  0.223189  0.03196      0            0            0            6.5411     0            14.3247   180          
1 1 1 0  0  14 o 0 28.1922  0.326085  -0.0525459   6.43502e-18  0            0            107.684    0            31.1733   180          
1 1 1 0  0  16 o 0 5.31977  0.216575  -0.0171022   2.09442e-18  0            0            2.78731    180          18.8834   -0           
1 1 1 0  0  18 f 1 4.41588  0.246298  -0.0320032   3.91926e-18  0            0            4.11813    0            26.1592   180          
1 1 1 0  0  20 o 0 3.79473  0.292754  -0.00167488  2.05114e-19  0            0            6.59143    180          54.1074   -0           
1 1 1 0  0  22 o 0 3.31662  0.290082  0.0500331    0            0            0            3.3821     0            18.0523   180          
1 1 1 0  1  1  f 1 54.9391  0.436998  -1.51818e-16 -0.826457    0            0            246.092    -90          39.1367   -90          
1 1 1 0  1  2  o 0 6.245    0.0555486 9.30241e-18  0.030384     0            0            1.45269    -90          12.1014   90           
1 1 1 0  1  3  o 0 2.91548  0.0833331 -9.96884e-19 -0.00542678  0            0            2.33259    90           63.4205   -90          
1 1 1 0  1  4  o 0 8.53815  0.086951  1.85958e-17  0.0607385    0            0            14.9801    90           27.8702   -90          
1 1 1 0  1  5  o 0 45.3938  0.318289  2.47336e-16  0.807861     0            0            199.277    -90          55.7338   -90          
1 1 1 0  1  6  f 1 36.1054  0.270774  -1.54474e-17 -0.0840919   0            0            158.321    90           51.8677   90           
1 1 1 0  1  7  o 0 3.78153  0.127827  9.54644e-18  0.031181     0            0            1.36887    -90          29.0121   90           
1 1 1 0  1  8  f 1 130.99   0.857037  -1.41411e-16 -0.769805    0            0            551.771    -90          23.1736   90           
1 1 1 0  1  9  o 0 24.6475  0.203207  -1.66796e-17 -0.0907995   0            0            103.335    90           76.3468   -90          
1 1 1 0  1  10 o 0 70.7835  0.491744  -9.12108e-18 -0.0496528   0            0            281.272    -90          27.6727   -90          
1 1 1 0  1  11 o 0 2.94958  0.22025   -1.68238e-18 -0.00915843  0            0            1.92511    -90          46.6461   90           
1 1 1 0  1  12 o 0 42.1806  0.310644  7.93408e-18  0.0259147    0            0            165.751    -90          58.8769   -90          
1 1 1 0  1  13 o 0 15.5563  0.165367  -9.24881e-18 -0.0503482   0            0            7.73729    90           2.60132   -90          
1 1 1 0  1  14 o 0 66.8042  0.507328  8.54911e-17  0.279235     0            0            262.041    90           45.0205   90           
1 1 1 0  1  15 o 0 7.89937  0.13686   9.54943e-18  0.0311908    0            0            15.5035    90           16.7716   -90          
1 1 1 0  1  16 o 0 31.4452  0.217914  2.00985e-17  0.0656465    0            0            121.556    -90          61.6405   90           
1 1 1 0  1  17 o 0 8.35464  0.129636  4.45662e-17  0.145564     0            0            19.6936    90           11.93     -90          
1 1 1 0  1  18 o 0 44.264   0.289533  -5.13258e-17 -0.279405    0            0            176.99     -90          6.32995   -90          
1 1 1 0  1  19 o 0 4.50555  0.191444  5.07093e-18  0.0165629    0            0            5.37484    90           10.6597   -90          
1 1 1 0  1  20 o 0 24.7992  0.186104  -2.42553e-17 -0.13204     0            0            97.3848    -90          49.6096   90           
1 1 1 0  1  21 o 0 12.4579  0.13106   -2.63383e-17 -0.143379    0            0            48.4505    -90          31.2038   90           
1 1 1 0  1  22 o 0 13.4276  0.140032  -3.47254e-18 -0.0189037   0            0            57.1629    90           0.907347  90           
1 1 1 0  1  23 o 0 27.4062  0.397389  -1.76623e-16 -0.96149     0            0            115.519    -90          33.5725   -90          
1 1 1 0  2  0  o 0 17.4385  0.20684   -0.160776    1.96894e-17  0            0            58.0081    0            73.7448   -180         
1 1 1 0  2  1  o 0 88.9371  0.609723  0.9081       0            0            0            399.74     0            58.5776   9.84624e-15  
1 1 1 0  2  2  o 0 46.5768  0.312431  -0.223333    2.73505e-17  0            0            208.12     180          76.9252   -0           
1 1 1 0  2  3  o 0 105.215  0.675214  1.2135       0            0            0            467.323    0            62.9518   5.23438e-14  
1 1 1 0  2  4  f 1 31.0998  0.232976  0.264037     0            0            0            137.204    0            28.8548   0            
1 1 1 0  2  5  o 0 45.0533  0.318472  0.0824835    0            0            0            198.151    0            13.2648   180          
1 1 1 0  2  6  o 0 56.2254  0.388587  0.437256     0            0            0            247.034    0            44.3363   180          
1 1 1 0  2  7  o 0 21.631   0.156052  -0.0896488   1.09788e-17  0            0            86.8195    180          17.7461   -180         
1 1 1 0  2  8  o 0 53.4921  0.327939  0.111736     0            0            0            225.173    180          40.8503   -180         
1 1 1 0  2  9  o 0 120.031  0.683007  -0.726126    8.89248e-17  0            0            502.738    180          43.5139   -8.30991e-14 
1 1 1 0  2  10 o 0 84.7874  0.498317  -0.278812    3.41446e-17  0            0            336.341    180          23.4001   -0           
1 1 1 0  2  11 o 0 96.5759  0.563613  -0.0387912   4.75056e-18  0            0            380.91     180          25.7434   -4.786e-14   
1 1 1 0  2  12 o 0 36.647   0.28699   -0.130989    1.60415e-17  0            0            143.644    0            16.0176   0            
1 1 1 0  2  13 o 0 43.2076  0.31135   0.235374     0            0            0            169.954    180          84.8457   -180         
1 1 1 0  2  14 o 0 11.2472  0.153485  0.0225165    0            0            0            21.8982    0            0.890001  180          
1 1 1 0  2  15 o 0 14.6082  0.152424  0.0507562    0            0            0            48.7099    -180         4.14982   180          
1 1 1 0  2  16 o 0 19.2302  0.175202  0.138285     0            0            0            74.0181    0            29.0662   180          
1 1 1 0  2  17 o 0 10.812   0.150498  -0.00641807  7.85987e-19  0            0            24.3618    180          4.81462   -0           
1 1 1 0  2  18 o 0 8.44985  0.133957  0.0959989    0            0            0            30.6112    0            11.2106   180          
1 1 1 0  2  19 o 0 38.5448  0.25771   -0.362316    4.43709e-17  0            0            152.035    180          29.2045   -180         
1 1 1 0  2  20 o 0 45.3343  0.293673  0.0429296    0            0            0            177.117    180          3.09434   -180         
1 1 1 0  2  21 o 0 11.0363  0.129848  -0.133066    1.62959e-17  0            0            39.406     180          17.1257   -180         
1 1 1 0  2  22 o 0 41.6989  0.308272  -0.965635    1.18256e-16  0            0            176.604    180          34.8161   -180         
1 1 1 0  2  23 o 0 19.1859  0.206257  0.215291     0            0            0            80.3852    180          13.678    -180         
1 1 1 0  3  1  o 0 7.30753  0.087886  1.71071e-17  0.0558761    0            0            5.71705    90           11.2746   -90          
1 1 1 0  3  2  o 0 11.7004  0.110067  -2.40328e-17 -0.130828    0            0            46.5922    -90          67.1094   90           
1 1 1 0  3  3  o 0 76.9142  0.618429  1.83249e-18  0.00598536   0            0            342.268    -90          35.6959   -90          
1 1 1 0  3  4  o 0 40.8571  0.314528  -1.2008e-16  -0.653686    0            0            180.832    -90          56.0319   -90          
1 1 1 0  3  5  o 0 78.3154  0.485392  -9.13733e-17 -0.497413    0            0            345.99     -90          28.9675   -90          
1 1 1 0  3  6  o 0 23.0499  0.159415  3.35459e-17  0.109569     0            0            98.1861    -90          2.13944   -90          
1 1 1 0  3  7  o 0 37.2666  0.237304  -1.87397e-17 -0.102014    0            0            157.542    -90          28.3876   -90          
1 1 1 0  3  8  o 0 8.09938  0.09759   1.85988e-17  0.0607482    0            0            3.36708    -90          15.743    90           
1 1 1 0  3  9  o 0 105.975  0.605638  2.53358e-17  0.0827532    0            0            443.162    90           24.1832   90           
1 1 1 0  3  10 o 0 93.2539  0.579738  5.22287e-17  0.170592     0            0            369.156    90           19.4744   -90          
1 1 1 0  3  11 o 0 13.8672  0.146279  2.50473e-18  0.00818107   0            0            5.72238    90           0.617206  -90          
1 1 1 0  3  12 o 0 17.1172  0.141949  -3.90002e-18 -0.0212307   0            0            45.0891    -90          3.22119   -90          
1 1 1 0  3  13 o 0 28.6653  0.230133  7.05046e-18  0.0230286    0            0            112.466    -90          38.011    90           
1 1 1 0  3  14 f 1 19.1337  0.163232  -3.38437e-17 -0.184236    0            0            20.2243    90           8.44559   90           
1 1 1 0  3  15 o 0 18.9578  0.151751  -3.33869e-18 -0.018175    0            0            71.0595    -90          18.2684   -90          
1 1 1 0  3  16 o 0 8.78635  0.145526  -1.34853e-17 -0.0734105   0            0            3.53717    -90          1.79142   -90          
1 1 1 0  3  17 o 0 2.93258  0.250472  -3.79275e-18 -0.0206467   0            0            0.370334   90           8.537     -90          
1 1 1 0  3  18 o 0 42.3415  0.343203  1.86194e-16  0.608155     0            0            167.693    90           13.9703   -90          
1 1 1 0  3  19 o 0 10.9909  0.143684  -9.0211e-18  -0.0491086   0            0            42.3404    90           10.7044   -90          
1 1 1 0  3  20 o 0 27.7363  0.225302  1.18475e-16  0.38697      0            0            107.751    90           5.2732    90           
1 1 1 0  3  21 o 0 79.3171  0.47809   1.91824e-16  0.626545     0            0            337.409    90           30.079    90           
1 1 1 0  3  22 o 0 22.4031  0.216615  3.30361e-17  0.107904     0            0            94.2893    -90          2.15635   -90          
1 1 1 0  3  23 o 0 22.1066  0.274762  1.67521e-16  0.547164     0            0            92.0157    90           1.70088   -90          
1 1 1 0  4  0  o 0 74.4325  0.580548  0.0688493    0            0            0            333.676    -180         87.8284   180          
1 1 1 0  4  1  o 0 42.1414  0.273483  -0.532739    6.52417e-17  0            0            188.756    180          37.3251   -4.19058e-14 
1 1 1 0  4  2  o 0 77.4713  0.539655  0.146457     0            0            0            345.994    180          26.137    -180         
1 1 1 0  4  3  o 0 33.1828  0.24678   -0.499677    6.11928e-17  0            0            147.533    180          19.2756   -180         
1 1 1 0  4  4  o 0 0.83666  0.227779  -0.000338671 4.14753e-20  0            0            0.0174768  0            6.14209   180          
1 1 1 0  4  5  o 0 56.1186  0.38668   -0.174066    2.1317e-17   0            0            247.814    0            33.4992   5.28801e-14  
1 1 1 0  4  6  o 0 36.0167  0.285101  -0.0132371   1.62108e-18  0            0            152.902    0            32.6292   0            
1 1 1 0  4  7  o 0 17.4184  0.162105  0.0509919    0            0            0            73.1215    0            86.8543   180          
1 1 1 0  4  8  o 0 50.2295  0.360732  0.0392975    0            0            0            210.859    0            67.6363   180          
1 1 1 0  4  9  o 0 90.5627  0.526399  0.68505      0            0            0            359.818    180          24.3568   -180         
1 1 1 0  4  10 o 0 18.1494  0.147561  -0.0260856   3.19456e-18  0            0            71.5509    0            110.675   180          
1 1 1 0  4  11 o 0 68.8251  0.421672  0.0644463    0            0            0            269.929    -180         26.3073   2.5368e-15   
1 1 1 0  4  12 o 0 6.77495  0.123201  -0.0117848   1.44322e-18  0            0            3.84368    180          13.9872   -0           
1 1 1 0  4  13 o 0 5.98331  0.146774  -0.0398412   4.87914e-18  0            0            12.9778    180          75.0653   -8.5132e-15  
1 1 1 0  4  14 o 0 15.9311  0.136913  0.0186594    0            0            0            60.5883    180          10.356    -0           
1 1 1 0  4  15 o 0 12.0913  0.122802  -0.065857    8.06515e-18  0            0            21.2375    0            1.00147   180          
1 1 1 0  4  16 o 0 2.38747  0.262666  0.000371606  0            0            0            0.0330604  0            0.614333  180          
1 1 1 0  4  17 o 0 64.6104  0.395342  0.0118523    0            0            0            256.843    0            2.0889    180          
1 1 1 0  4  18 o 0 14.7648  0.134231  -0.0461001   5.64564e-18  0            0            57.2284    0            16.524    0            
1 1 1 0  4  19 o 0 55.3028  0.394087  0.775638     0            0            0            215.688    0            5.40561   180          
1 1 1 0  4  20 o 0 21.4988  0.189038  -0.015243    1.86673e-18  0            0            83.0007    0            22.6937   0            
1 1 1 0  4  21 o 0 3.19374  0.24639   0.0757553    0            0            0            0.818202   0            1.6764    0            
1 1 1 0  4  22 o 0 24.0499  0.281509  0.140164     0            0            0            100.53     0            27.6434   0            
1 1 1 0  4  23 o 0 22.6208  0.264346  -0.305476    3.741e-17    0            0            93.4853    180          18.9449   -0           
1 1 1 0  5  1  o 0 4.12311  0.0597614 1.51066e-18  0.00493419   0            0            1.12716    90           12.9173   -90          
1 1 1 0  5  2  o 0 10.4115  0.0857337 3.38793e-17  0.110658     0            0            14.4118    -90          28.154    90           
1 1 1 0  5  3  o 0 23.3987  0.194961  1.6602e-17   0.0542262    0            0            102.986    90           8.08651   -90          
1 1 1 0  5  4  o 0 3.87298  0.0759554 1.65236e-17  0.05397      0            0            0.102418   90           12.7388   90           
1 1 1 0  5  5  o 0 19.3907  0.150955  -2.35666e-17 -0.128291    0            0            74.6214    90           7.15105   -90          
1 1 1 0  5  6  f 1 82.3055  0.550341  -2.67089e-17 -0.145396    0            0            348.776    -90          37.9671   -90          
1 1 1 0  5  7  f 1 24.5825  0.193728  -1.09485e-17 -0.0596009   0            0            103.225    -90          21.3298   90           
1 1 1 0  5  8  o 0 87.574   0.588672  -9.85826e-17 -0.536659    0            0            349.124    -90          14.9318   90           
1 1 1 0  5  9  o 0 17.2076  0.172602  1.13334e-17  0.0370175    0            0            54.1851    90           1.32242   -90          
1 1 1 0  5  10 o 0 64.2962  0.447906  -2.75714e-17 -0.150092    0            0            252.979    90           29.2408   90           
1 1 1 0  5  11 o 0 14.4568  0.143822  1.28346e-17  0.0419209    0            0            16.9014    90           0.310328  90           
1 1 1 0  5  12 o 0 27.7308  0.227119  7.78863e-18  0.0254396    0            0            104.371    -90          40.2789   -90          
1 1 1 0  5  13 o 0 6.1563   0.135074  7.82034e-18  0.0255432    0            0            1.88952    90           2.34007   -90          
1 1 1 0  5  14 o 0 43.0593  0.274606  1.14421e-16  0.373728     0            0            166.197    90           4.51033   90           
1 1 1 0  5  15 o 0 25.9037  0.185893  -1.7771e-17  -0.0967406   0            0            99.1388    90           22.7444   -90          
1 1 1 0  5  16 o 0 9.94485  0.124134  2.61468e-17  0.0854018    0            0            21.906     90           4.99464   -90          
1 1 1 0  5  17 o 0 30.7555  0.211511  -4.52574e-17 -0.24637     0            0            121.542    -90          9.34763   -90          
1 1 1 0  5  18 o 0 6.81909  0.136553  -1.57213e-17 -0.0855829   0            0            20.9743    -90          13.715    90           
1 1 1 0  5  19 o 0 10.2956  0.129485  1.2281e-17   0.0401127    0            0            26.5557    -90          6.88725   -90          
1 1 1 0  5  20 o 0 48.4252  0.305754  -1.51649e-16 -0.825537    0            0            185.68     -90          4.11654   -90          
1 1 1 0  5  21 o 0 43.9955  0.321539  2.33172e-17  0.0761597    0            0            184.609    90           49.6452   90           
1 1 1 0  5  22 o 0 20.6785  0.220098  -4.90303e-17 -0.266908    0            0            85.7951    -90          10.9228   -90          
1 1 1 0  5  23 o 0 13.1111  0.269001  -1.44206e-17 -0.0785021   0            0            53.7601    -90          6.57779   -90          
1 1 1 0  6  0  o 0 48.4644  0.458861  0.251737     0            0            0            216.234    0            66.6233   3.55753e-14  
1 1 1 0  6  1  o 0 63.1854  0.356452  0.449079     0            0            0            281.867    -180         46.8296   180          
1 1 1 0  6  2  o 0 31.7537  0.186283  0.0297347    0            0            0            141.123    180          21.5611   -180         
1 1 1 0  6  3  o 0 36.775   0.320779  0.371908     0            0            0            157.682    180          20.9777   -2.83859e-14 
1 1 1 0  6  4  o 0 80.2228  0.485074  -0.238387    2.9194e-17   0            0            342.452    0            10.2617   0            
1 1 1 0  6  5  o 0 46.6187  0.276145  0.0877753    0            0            0            197.989    0            43.5617   180          
1 1 1 0  6  6  o 0 20.035   0.138791  -0.0665746   8.15304e-18  0            0            82.8368    0            30.6924   180          
1 1 1 0  6  7  o 0 38.1838  0.25753   -0.0691814   8.47228e-18  0            0            150.244    -180         93.5493   180          
1 1 1 0  6  8  o 0 12.6531  0.121331  -0.0420289   5.14706e-18  0            0            41.6875    0            47.0685   180          
1 1 1 0  6  9  o 0 76.9675  0.525198  -0.345288    4.22856e-17  0            0            303.661    0            19.0021   0            
1 1 1 0  6  10 o 0 59.1422  0.413885  0.306336     0            0            0            231.704    180          8.74811   -180         
1 1 1 0  6  11 f 1 48.3405  0.491457  -0.0432471   5.29625e-18  0            0            190.069    180          46.6392   -1.01829e-14 
1 1 1 0  6  12 o 0 21.6726  0.187549  0.217877     0            0            0            84.5427    0            12.6831   180          
1 1 1 0  6  13 o 0 9.51315  0.134731  0.0527788    0            0            0            18.7113    0            7.11454   180          
1 1 1 0  6  14 o 0 25.5871  0.234292  -0.0617177   7.55823e-18  0            0            98.2034    0            3.03946   180          
1 1 1 0  6  15 o 0 9.35949  0.131688  0.0712335    0            0            0            26.9171    0            17.6789   180          
1 1 1 0  6  16 o 0 15.8902  0.143442  -0.109827    1.345e-17    0            0            51.1095    0            12.3861   0            
1 1 1 0  6  17 o 0 2.25832  0.256893  0.00119429   0            0            0            1.59666    180          18.1535   -0           
1 1 1 0  6  18 o 0 4.52769  0.170173  -0.0292532   3.58249e-18  0            0            7.57296    0            18.4787   180          
1 1 1 0  6  19 o 0 13.0537  0.128951  -0.182136    2.23053e-17  0            0            50.1924    -180         0.0361482 7.41845e-12  
1 1 1 0  6  20 o 0 28.3549  0.197874  -0.0181807   2.2265e-18   0            0            119.384    0            21.5079   180          
1 1 1 0  6  21 o 0 13.2212  0.179084  -0.261177    3.1985e-17   0            0            55.0442    180          13.2311   -0           
1 1 1 0  6  22 o 0 13.4164  0.383896  0.25551      0            0            0            55.2164    0            9.61811   180          
1 1 1 0  7  1  o 0 48.8569  0.323294  -3.06703e-17 -0.166962    0            0            209.729    90           35.2917   90           
1 1 1 0  7  2  o 0 18.303   0.122113  -1.17315e-17 -0.0638635   0            0            73.9971    90           25.0134   -90          
1 1 1 0  7  3  o 0 47.1031  0.406221  -1.64488e-17 -0.0895429   0            0            200.996    90           18.1026   -90          
1 1 1 0  7  4  o 0 57.7252  0.490401  -2.87118e-17 -0.1563      0            0            245.26     -90          94.3741   90           
1 1 1 0  7  5  o 0 23.0391  0.227781  4.84966e-17  0.158402     0            0            78.5085    90           34.8652   90           
1 1 1 0  7  6  o 0 2.09762  0.19545   -8.14105e-20 -0.000443178 0            0            0.11799    -90          5.85925   90           
1 1 1 0  7  7  o 0 7.74597  0.108212  1.11968e-17  0.0365714    0            0            2.2257     90           2.00318   -90          
1 1 1 0  7  8  o 0 133.906  0.860361  6.34546e-17  0.207258     0            0            529.31     -90          125.247   -90          
1 1 1 0  7  9  o 0 35.5148  0.244685  -1.98388e-17 -0.107997    0            0            139.418    90           6.83557   -90          
1 1 1 0  7  10 o 0 18.9209  0.149442  7.88207e-18  0.0257448    0            0            42.1894    -90          10.2122   -90          
1 1 1 0  7  11 o 0 41.1692  0.282252  -6.05069e-17 -0.329384    0            0            160.989    -90          25.7674   90           
1 1 1 0  7  12 o 0 35.5387  0.236194  -4.75065e-18 -0.0258613   0            0            137.869    90           37.8904   90           
1 1 1 0  7  13 o 0 32.6634  0.259688  -4.59913e-17 -0.250365    0            0            125.664    -90          22.708    90           
1 1 1 0  7  14 o 0 35.1127  0.269899  -2.99131e-17 -0.162839    0            0            133.916    -90          48.3167   90           
1 1 1 0  7  15 f 1 32.2444  0.255379  5.92871e-17  0.193647     0            0            128.131    -90          25.8406   90           
1 1 1 0  7  16 o 0 6.41093  0.144873  -4.52776e-18 -0.0246479   0            0            2.73942    -90          0.470621  90           
1 1 1 0  7  17 o 0 42.6357  0.316622  2.3684e-16   0.77358      0            0            166.178    90           2.01606   90           
1 1 1 0  7  18 o 0 3.74166  0.214516  5.70871e-18  0.0186461    0            0            6.93352    -90          27.7131   90           
1 1 1 0  7  19 o 0 22.5477  0.195654  5.16008e-18  0.0168541    0            0            86.0625    -90          0.360344  -90          
1 1 1 0  7  20 o 0 11.6447  0.190092  5.85736e-17  0.191316     0            0            48.596     90           9.83645   -90          
1 1 1 0  7  21 o 0 15.9875  0.270596  -4.3019e-17  -0.234184    0            0            66.0043    90           13.0486   90           
1 1 1 0  7  22 o 0 15.0033  0.367472  5.52629e-17  0.180502     0            0            61.2102    90           7.09472   -90          
1 1 1 0  8  0  o 0 13.1149  0.154481  -0.045027    5.51421e-18  0            0            29.4439    -180         51.3309   1.1453e-13   
1 1 1 0  8  1  o 0 16.7003  0.110049  0.00349736   0            0            0            64.3104    0            36.6222   -180         
1 1 1 0  8  2  o 0 29.7641  0.190286  -0.0446665   5.47006e-18  0            0            119.404    0            35.7873   0            
1 1 1 0  8  3  o 0 73.8356  0.607157  -0.114829    1.40625e-17  0            0            298.3      -180         49.9281   180          
1 1 1 0  8  4  o 0 34.069   0.309771  0.107494     0            0            0            42.8031    180          31.1018   -180         
1 1 1 0  8  5  o 0 27.4536  0.27051   -0.0334886   4.10117e-18  0            0            108.632    180          23.2185   -180         
1 1 1 0  8  6  o 0 6.30079  0.109188  0.031411     0            0            0            6.08824    180          34.491    -0           
1 1 1 0  8  7  o 0 53.4238  0.367154  0.0270869    0            0            0            211.345    180          18.3872   -7.25921e-15 
1 1 1 0  8  8  o 0 22.6363  0.151394  0.0950376    0            0            0            87.2493    180          9.14293   -0           
1 1 1 0  8  9  o 0 73.1574  0.42604   -0.10326     1.26458e-17  0            0            288.633    0            36.7812   1.72527e-14  
1 1 1 0  8  10 o 0 10.8582  0.122931  -0.0930116   1.13906e-17  0            0            37.6288    180          21.2428   -0           
1 1 1 0  8  11 o 0 81.119   0.476123  -0.015634    1.91461e-18  0            0            315.197    0            3.65501   9.0019e-14   
1 1 1 0  8  12 o 0 68.7263  0.407895  -0.801262    9.81262e-17  0            0            264.861    180          128.205   -180         
1 1 1 0  8  13 f 1 16.0499  0.132853  0.0500498    0            0            0            43.5956    0            18.6144   0            
1 1 1 0  8  14 o 0 19.5346  0.1549    0.0355292    0            0            0            74.5635    180          24.4687   -180         
1 1 1 0  8  15 o 0 14.8728  0.129971  -0.0372085   4.55672e-18  0            0            58.6538    180          17.8109   -3.9203e-14  
1 1 1 0  8  16 o 0 15.6429  0.136251  0.187506     0            0            0            61.0954    0            11.7907   180          
1 1 1 0  8  17 o 0 7.5233   0.130632  0.00679259   0            0            0            26.4764    0            22.0047   180          
1 1 1 0  8  18 o 0 29.4126  0.296194  0.404685     0            0            0            112.534    0            22.0396   0            
1 1 1 0  8  19 o 0 9.22497  0.185918  0.0734691    0            0            0            7.01879    180          1.99176   -180         
1 1 1 0  8  20 o 0 14.6219  0.353805  0.00970115   0            0            0            60.5256    0            12.3609   180          
1 1 1 0  8  21 o 0 32.4006  0.421931  0.31375      0            0            0            132.551    0            24.0089   1.55849e-14  
1 1 1 0  9  1  o 0 6.76018  0.0731664 7.13842e-18  0.0233158    0            0            1.58633    -90          9.61764   90           
1 1 1 0  9  2  o 0 35.833   0.209472  1.08453e-17  0.0354234    0            0            141.889    90           81.2376   90           
1 1 1 0  9  3  o 0 38.1615  0.324779  1.52826e-17  0.0499169    0            0            153.16     -90          28.7624   -90          
1 1 1 0  9  4  o 0 22.7816  0.221697  -1.00563e-17 -0.0547439   0            0            83.794     -90          21.7572   -90          
1 1 1 0  9  5  o 0 24.5296  0.248194  -2.53685e-17 -0.1381      0            0            96.5836    90           7.67594   -90          
1 1 1 0  9  6  o 0 69.6807  0.586314  3.07998e-17  0.1006       0            0            275.523    90           4.64291   90           
1 1 1 0  9  7  o 0 14.5396  0.122759  -1.31373e-17 -0.071516    0            0            53.0174    -90          41.531    90           
1 1 1 0  9  8  o 0 22.9325  0.16237   2.21662e-17  0.0724003    0            0            87.725     90           8.17087   90           
1 1 1 0  9  9  o 0 17.7313  0.139885  1.33958e-17  0.0437541    0            0            69.4341    -90          44.0637   90           
1 1 1 0  9  10 o 0 19.8167  0.155214  6.51542e-18  0.021281     0            0            76.255     -90          11.2826   -90          
1 1 1 0  9  11 o 0 69.5981  0.433368  1.73415e-16  0.566415     0            0            268.475    90           10.7853   -90          
1 1 1 0  9  12 o 0 4.219    0.148729  1.21501e-18  0.00396853   0            0            2.69838    -90          16.8929   90           
1 1 1 0  9  13 o 0 24.7447  0.174559  8.47141e-17  0.276697     0            0            98.6363    90           3.47429   90           
1 1 1 0  9  14 o 0 91.9048  0.530632  -1.21343e-16 -0.660561    0            0            363.018    -90          44.4019   -90          
1 1 1 0  9  15 o 0 15.5692  0.130571  -1.9412e-17  -0.105674    0            0            59.9772    90           20.4334   90           
1 1 1 0  9  16 f 1 34.8554  0.27186   -3.23551e-17 -0.176133    0            0            134.999    -90          17.5082   -90          
1 1 1 0  9  17 o 0 7.04982  0.179759  -2.56803e-17 -0.139797    0            0            22.5536    -90          2.34335   90           
1 1 1 0  9  18 o 0 3.755    0.225701  6.09149e-18  0.0198963    0            0            2.73747    -90          6.59283   90           
1 1 1 0  9  19 o 0 5.36656  0.214833  -5.61231e-18 -0.030552    0            0            8.23944    90           5.71019   -90          
1 1 1 0  9  20 o 0 6.97137  0.229033  -8.0122e-18  -0.0436164   0            0            21.4524    90           2.85241   90           
1 1 1 0  9  21 o 0 1.14018  0.795741  6.45905e-18  0.0210969    0            0            0.20947    90           2.47169   -90          
1 1 1 0  10 0  f 1 117.189  0.907702  0.230203     0            0            0            471.136    -180         43.4068   3.67583e-14  
1 1 1 0  10 1  o 0 16.2111  0.125481  -0.0435936   5.33867e-18  0            0            64.0384    180          72.1389   -0           
1 1 1 0  10 2  f 1 40.3943  0.231377  0.0809206    0            0            0            161.55     0            38.6737   0            
1 1 1 0  10 3  o 0 41.3534  0.342944  -0.0648443   7.94113e-18  0            0            164.776    0            29.7651   4.22753e-14  
1 1 1 0  10 4  o 0 13.975   0.173155  -0.0245742   3.00947e-18  0            0            32.2175    180          9.39947   -0           
1 1 1 0  10 5  o 0 30.6659  0.279513  0.00450913   0            0            0            39.0884    0            29.3106   0            
1 1 1 0  10 6  f 1 49.9039  0.437988  -0.212462    2.60191e-17  0            0            198.001    180          3.14574   -180         
1 1 1 0  10 7  o 0 20.1395  0.221003  0.0220478    0            0            0            79.4026    180          49.787    -2.62089e-14 
1 1 1 0  10 8  o 0 4.64758  0.21568   -0.0177625   2.17528e-18  0            0            6.69561    180          32.1116   -0           
1 1 1 0  10 9  o 0 73.1266  0.597478  0.64271      0            0            0            284.294    0            15.7268   7.52052e-14  
1 1 1 0  10 10 o 0 36.2381  0.241227  0.182158     0            0            0            139.794    0            60.7258   0            
1 1 1 0  10 11 o 0 16.9293  0.152206  0.0643692    0            0            0            63.2801    0            16.0885   0            
1 1 1 0  10 12 o 0 67.2228  0.423518  0.824366     0            0            0            268.116    0            2.32237   0            
1 1 1 0  10 13 o 0 21.7945  0.154898  -0.278857    3.41501e-17  0            0            86.1438    -180         21.8299   180          
1 1 1 0  10 14 o 0 68.9101  0.534225  0.063231     0            0            0            269.813    0            37.4759   0            
1 1 1 0  10 15 o 0 11.7004  0.143523  -0.0696914   8.53474e-18  0            0            27.3328    -180         14.4447   180          
1 1 1 0  10 16 o 0 10.5499  0.149526  -0.139067    1.70308e-17  0            0            31.1143    0            13.011    0            
1 1 1 0  10 17 o 0 14.3108  0.179417  -0.0446624   5.46957e-18  0            0            53.1446    0            26.9095   -1.9399e-14  
1 1 1 0  10 18 o 0 23.7571  0.208623  -0.355313    4.35133e-17  0            0            98.6877    180          0.873792  -0           
1 1 1 0  10 19 o 0 12.3531  0.327167  0.075838     0            0            0            50.7207    0            3.03381   0            
1 1 1 0  11 1  o 0 91.151   0.505141  -4.16078e-17 -0.226502    0            0            366.851    90           49.1672   -90          
1 1 1 0  11 2  o 0 39.9337  0.350004  1.15152e-17  0.0376114    0            0            160.162    -90          56.9971   -90          
1 1 1 0  11 3  o 0 50.7622  0.432645  5.38354e-18  0.017584     0            0            202.862    -90          21.8445   90           
1 1 1 0  11 4  o 0 12.3288  0.152219  2.69412e-17  0.0879965    0            0            46.2503    90           21.4107   -90          
1 1 1 0  11 5  o 0 97.3761  0.777835  8.24209e-17  0.269207     0            0            385.371    -90          3.14807   -90          
1 1 1 0  11 6  o 0 2.93258  0.279051  -1.12574e-18 -0.00612826  0            0            3.18086    -90          43.2824   90           
1 1 1 0  11 7  o 0 4.86826  0.197256  6.71179e-18  0.0219224    0            0            3.03071    90           10.8995   -90          
1 1 1 0  11 8  o 0 51.5199  0.452149  -7.9439e-17  -0.432446    0            0            200.038    -90          12.65     -90          
1 1 1 0  11 9  f 1 10.9818  0.174763  1.44508e-18  0.00472      0            0            6.54699    90           0.0910021 -90          
1 1 1 0  11 10 o 0 14.025   0.172552  -1.80922e-17 -0.0984894   0            0            54.7812    -90          17.6694   90           
1 1 1 0  11 11 o 0 59.8164  0.407635  -1.03948e-16 -0.565869    0            0            238.484    90           40.6049   90           
1 1 1 0  11 12 o 0 42.0048  0.392695  6.2353e-18   0.020366     0            0            166.003    90           23.3683   -90          
1 1 1 0  11 13 f 1 19.4268  0.196189  -1.71715e-17 -0.0934772   0            0            75.9817    90           28.2096   90           
1 1 1 0  11 14 f 1 51.9538  0.470185  2.3627e-16   0.771718     0            0            201.48     90           11.2859   90           
1 1 1 0  11 15 f 1 5.68331  0.179023  1.18795e-17  0.0388013    0            0            21.0889    -90          39.2809   90           
1 1 1 0  11 16 o 0 7.10633  0.131237  2.57479e-17  0.0840989    0            0            21.6581    -90          5.71048   90           
1 1 1 0  11 17 o 0 5.31037  0.19075   1.9676e-17   0.0642667    0            0            13.7392    -90          12.995    90           
1 1 1 0  11 18 o 0 27.8478  0.420913  -5.41788e-17 -0.294935    0            0            114.469    90           8.89608   -90          
1 1 1 0  12 0  f 1 31.6006  0.263609  0.00425283   0            0            0            91.8893    0            62.8322   0            
1 1 1 0  12 1  o 0 29.5076  0.188572  0.118777     0            0            0            117.773    0            20.7155   3.18589e-14  
1 1 1 0  12 2  o 0 11.0589  0.142823  -0.0308541   3.77854e-18  0            0            2.16542    0            1.43915   180          
1 1 1 0  12 3  o 0 72.742   0.593824  0.345121     0            0            0            288.175    0            13.2168   2.50771e-14  
1 1 1 0  12 4  f 1 19.5397  0.195077  0.000952631  0            0            0            77.0229    180          34.8149   -0           
1 1 1 0  12 5  o 0 14.856   0.163116  0.0262588    0            0            0            57.0771    0            17.5998   180          
1 1 1 0  12 6  o 0 34.8956  0.313824  0.226822     0            0            0            136.052    180          8.50996   -180         
1 1 1 0  12 7  f 1 10.7471  0.169447  -0.0520739   6.37721e-18  0            0            8.69873    0            3.21002   180          
1 1 1 0  12 8  o 0 18.262   0.203074  -0.0121338   1.48596e-18  0            0            73.7957    0            34.7188   180          
1 1 1 0  12 9  o 0 36.0139  0.347877  -0.582788    7.13709e-17  0            0            144.553    180          14.6183   -180         
1 1 1 0  12 10 f 1 17.2366  0.212035  -0.0370486   4.53715e-18  0            0            68.5793    180          12.551    -180         
1 1 1 0  12 11 o 0 96.7001  0.79743   -0.550008    6.73565e-17  0            0            381.762    180          113.06    -180         
1 1 1 0  12 12 o 0 33.0136  0.312058  -0.0825692   1.01118e-17  0            0            129.17     0            6.60649   0            
1 1 1 0  12 13 o 0 37.0675  0.306353  0.620188     0            0            0            143.672    0            22.4335   3.23323e-14  
1 1 1 0  12 14 o 0 13.7659  0.203988  -0.0177201   2.17009e-18  0            0            49.5944    180          29.0736   -180         
1 1 1 0  12 15 o 0 59.4399  0.460749  1.04876      0            0            0            225.791    0            28.5387   1.91386e-14  
1 1 1 0  12 16 o 0 4.59347  0.247537  0.0518439    0            0            0            6.85261    0            5.76236   180          
1 1 1 0  12 17 o 0 11.9917  0.25711   0.0633856    0            0            0            49.3003    0            2.93359   180          
1 1 1 0  13 1  o 0 11.1669  0.0888406 7.54661e-18  0.0246491    0            0            36.1671    90           13.8302   -90          
1 1 1 0  13 2  o 0 10.0499  0.127721  -1.06613e-17 -0.0580372   0            0            39.228     -90          88.6825   90           
1 1 1 0  13 3  o 0 65.6849  0.620585  -3.39884e-17 -0.185024    0            0            257.779    90           22.8571   90           
1 1 1 0  13 4  o 0 3.52136  0.213803  -5.87358e-18 -0.0319743   0            0            8.67228    -90          87.7099   90           
1 1 1 0  13 5  o 0 10.7657  0.142088  1.22891e-17  0.0401393    0            0            39.7146    90           29.0832   -90          
1 1 1 0  13 6  o 0 7.96241  0.147934  4.32226e-18  0.0141176    0            0            21.9157    90           29.8257   -90          
1 1 1 0  13 7  o 0 9.76729  0.161132  -1.43357e-18 -0.00780401  0            0            33.3801    -90          30.633    90           
1 1 1 0  13 8  o 0 15.9154  0.183233  7.46845e-17  0.243938     0            0            30.6942    -90          18.7002   -90          
1 1 1 0  13 9  o 0 19.4191  0.208874  -1.10644e-17 -0.0602319   0            0            77.143     90           24.0608   -90          
1 1 1 0  13 10 o 0 26.6158  0.269649  9.31025e-17  0.304096     0            0            104.869    -90          31.8765   -90          
1 1 1 0  13 11 o 0 46.7033  0.436974  5.6702e-17   0.185203     0            0            182.426    -90          40.2803   -90          
1 1 1 0  13 12 o 0 5.90762  0.204396  -4.88437e-18 -0.0265893   0            0            1.35509    -90          0.0252157 -90          
1 1 1 0  13 13 f 1 27.0093  0.280312  -2.36739e-17 -0.128875    0            0            103.54     -90          13.0301   90           
1 1 1 0  13 14 o 0 16.2573  0.212492  -7.08764e-17 -0.385833    0            0            67.7187    -90          41.2612   -90          
1 1 1 0  13 15 o 0 5.18652  0.221689  -5.99395e-18 -0.0326295   0            0            0.131209   -90          1.04669   -90          
1 1 1 0  13 16 o 0 2.84605  0.342681  -1.0771e-17  -0.0586348   0            0            1.02569    -90          0.288279  90           
1 1 1 0  13 17 f 1 6.12372  0.376245  1.17031e-17  0.0382251    0            0            17.0774    90           0.526373  90           
1 1 1 0  14 0  o 0 2.70185  0.173547  -0.00850312  1.04133e-18  0            0            1.52387    -180         47.7713   6.49761e-14  
1 1 1 0  14 1  o 0 60.2735  0.389848  -0.16833     2.06145e-17  0            0            248.282    180          32.8012   -180         
1 1 1 0  14 2  o 0 25.1794  0.236067  0.0525547    0            0            0            103.213    0            26.9306   0            
1 1 1 0  14 3  o 0 35.8831  0.309444  -0.282968    3.46536e-17  0            0            146.578    180          57.464    -180         
1 1 1 0  14 4  o 0 48.2431  0.406973  0.189557     0            0            0            196.067    0            7.10037   180          
1 1 1 0  14 5  o 0 15.9562  0.173582  -0.0801958   9.82115e-18  0            0            64.4131    -180         6.44588   180          
1 1 1 0  14 6  o 0 24.5927  0.237602  -0.0124151   1.52041e-18  0            0            98.7639    0            12.3316   0            
1 1 1 0  14 7  o 0 23.7887  0.228988  0.219982     0            0            0            94.8877    -180         3.00063   180          
1 1 1 0  14 8  o 0 64.4562  0.540013  0.309195     0            0            0            255.223    0            17.9435   180          
1 1 1 0  14 9  o 0 64.7055  0.541006  1.05419      0            0            0            254.205    0            6.28025   180          
1 1 1 0  14 10 o 0 25.6652  0.260348  -0.11381     1.39376e-17  0            0            99.9903    180          20.7217   -0           
1 1 1 0  14 11 o 0 10.7842  0.182346  0.0386222    0            0            0            41.6347    180          28.387    -5.06785e-14 
1 1 1 0  14 12 o 0 93.3204  0.785787  -0.973005    1.19159e-16  0            0            357.027    180          19.1265   -0           
1 1 1 0  14 13 o 0 23.6284  0.25953   -0.409322    5.01275e-17  0            0            99.0333    180          9.44642   -180         
1 1 1 0  14 14 o 0 30.6137  0.316822  -0.0323217   3.95826e-18  0            0            127.003    180          3.20336   -0           
1 1 1 0  14 15 o 0 7.42967  0.19662   -0.22435     2.74749e-17  0            0            17.5468    180          10.1446   -180         
1 1 1 0  14 16 o 0 24.986   0.380381  -0.0732558   8.97125e-18  0            0            101.419    0            0.555486  180          
1 1 1 0  15 1  o 0 14.2724  0.21057   1.31361e-17  0.0429057    0            0            57.9853    -90          1.12091   -90          
1 1 1 0  15 2  o 0 49.3538  0.78669   1.20277e-16  0.392855     0            0            200.393    -90          24.7421   90           
1 1 1 0  15 3  f 1 3.28634  0.305057  1.59928e-18  0.00522364   0            0            5.70953    90           28.9419   -90          
1 1 1 0  15 4  f 1 32.8603  0.419144  4.40038e-17  0.143727     0            0            132.093    90           20.7153   -90          
1 1 1 0  15 5  o 0 51.7281  0.626452  -9.05957e-17 -0.49318     0            0            206.721    -90          26.8932   -90          
1 1 1 0  15 6  o 0 21.5337  0.213807  -2.80306e-18 -0.0152592   0            0            85.5031    90           13.5174   90           
1 1 1 0  15 7  o 0 31.5737  0.34151   -3.08655e-17 -0.168024    0            0            124.498    -90          41.8855   -90          
1 1 1 0  15 8  f 1 7.56968  0.155308  -1.72488e-17 -0.0938982   0            0            11.0463    90           0.234561  90           
1 1 1 0  15 9  f 1 12.4056  0.163089  1.86005e-17  0.0607538    0            0            48.1624    90           32.4609   -90          
1 1 1 0  15 10 f 1 14.0748  0.20999   -3.99639e-17 -0.217554    0            0            54.1694    -90          1.88709   -90          
1 1 1 0  15 11 o 0 11.4368  0.180739  2.51068e-17  0.0820052    0            0            48.2152    90           10.3042   -90          
1 1 1 0  15 12 o 0 7.25259  0.201165  2.47691e-17  0.0809019    0            0            2.42026    90           2.44272   90           
1 1 1 0  15 13 o 0 19.0184  0.231157  1.18958e-16  0.388547     0            0            78.7163    90           12.4347   -90          
1 1 1 0  15 14 o 0 2        0.424721  1.74167e-17  0.0568873    0            0            2.70843    90           15.5323   -90          
1 1 1 0  15 15 o 0 12.5857  0.264529  4.17985e-18  0.0136524    0            0            50.9915    -90          5.09032   90           
1 1 1 0  16 0  f 1 45.7351  0.502804  0.257608     0            0            0            185.162    0            34.2481   180          
1 1 1 0  16 1  o 0 63.0436  0.705844  -0.0816194   9.99549e-18  0            0            254.257    180          41.5624   -180         
1 1 1 0  16 2  o 0 35.8622  0.433899  0.0607199    0            0            0            143.997    0            18.1128   180          
1 1 1 0  16 3  o 0 4.80625  0.25643   0.0332813    0            0            0            11.8408    0            23.5233   180          
1 1 1 0  16 4  o 0 9.39681  0.197981  -0.0768663   9.41341e-18  0            0            19.1717    180          10.2397   -180         
1 1 1 0  16 5  o 0 26.6496  0.349976  0.135776     0            0            0            105.247    180          29.2948   -180         
1 1 1 0  16 6  o 0 6.52687  0.243543  -0.0573421   7.02238e-18  0            0            22.4725    0            14.3487   180          
1 1 1 0  16 9  o 0 26.803   0.382518  -0.264645    3.24096e-17  0            0            113.68     0            6.93576   180          
1 1 1 0  16 10 o 0 5.49545  0.260325  0.0696456    0            0            0            7.05569    0            1.21263   0            
1 1 1 0  16 11 o 0 2.30217  0.476866  0.00104181   0            0            0            1.12955    0            5.46508   180          
1 1 1 0  16 12 o 0 0.707107 0.674312  0.0189271    0            0            0            0.0864553  0            1.85633   180          
1 1 1 0  16 13 o 0 8.39047  0.254373  0.13083      0            0            0            33.6207    0            0.415914  0            
1 1 1 0  17 1  o 0 29.6699  0.341515  -6.36164e-17 -0.346312    0            0            118.291    -90          29.7404   90           
1 1 1 0  17 2  o 0 4.49444  0.20208   -5.10459e-18 -0.0277881   0            0            6.224      -90          6.34295   90           
1 1 1 0  17 3  o 0 50.1558  0.59697   6.1845e-17   0.202001     0            0            219.044    -90          53.2798   -90          
1 1 1 0  17 4  o 0 5.11859  0.215413  3.19007e-18  0.0104196    0            0            2.53642    90           1.26978   -90          
1 1 1 0  17 5  o 0 18.1108  0.255873  9.28562e-17  0.303291     0            0            78.1452    -90          13.8066   -90          
1 1 1 0  17 6  o 0 34.5731  0.606788  -1.03657e-17 -0.0564282   0            0            148.163    90           6.49119   90           
1 1 1 0  17 7  o 0 26.3382  0.374319  8.53645e-17  0.278822     0            0            112.044    90           19.2998   90           
1 1 1 0  17 8  o 0 29.2916  0.397417  8.6485e-17   0.282481     0            0            123.629    -90          30.4097   -90          
1 1 1 0  17 9  o 0 22.3069  0.31384   -5.13088e-17 -0.279312    0            0            93.3622    -90          6.14425   90           
1 1 1 0  17 10 o 0 19.652   0.290801  8.86759e-17  0.289637     0            0            81.5217    90           22.7821   -90          
1 1 1 0  17 11 o 0 12.8919  0.239837  -7.00714e-17 -0.381451    0            0            52.9727    -90          8.61546   -90          
1 1 1 1  0  1  f 1 44.3531  0.260009  -5.0322e-17  -0.27394     0            0            193.572    -90          154.17    -90          
1 1 1 1  0  2  o 0 49.3953  0.294822  -0.773696    9.47505e-17  0            0            226.818    180          67.3034   -2.11213e-14 
1 1 1 1  0  3  o 0 14.7479  0.111041  -1.08484e-17 -0.0590559   0            0            54.5419    90           30.0772   -90          
1 1 1 1  0  4  o 0 39.5449  0.288693  -0.644005    7.88679e-17  0            0            178.863    180          27.6533   -180         
1 1 1 1  0  5  o 0 9.52365  0.0935775 2.7423e-18   0.00895705   0            0            11.0172    90           16.6103   -90          
1 1 1 1  0  6  f 1 42.3851  0.308004  0.204433     0            0            0            189.706    0            51.4446   180          
1 1 1 1  0  7  o 0 8.56738  0.126512  -9.97961e-19 -0.00543265  0            0            3.07406    -90          5.93642   90           
1 1 1 1  0  8  f 1 34.7491  0.31371   0.43431      0            0            0            148.498    -180         5.90237   180          
1 1 1 1  0  9  o 0 84.2199  0.688367  5.97512e-17  0.195162     0            0            357.747    90           53.5078   90           
1 1 1 1  0  10 o 0 58.0706  0.498537  0.114202     0            0            0            233.39     180          75.4687   -1.89434e-14 
1 1 1 1  0  11 o 0 54.0546  0.467681  -2.62964e-18 -0.0143151   0            0            215.821    -90          22.4257   -90          
1 1 1 1  0  12 o 0 61.9258  0.437745  -0.103933    1.27282e-17  0            0            245.555    0            13.0395   180          
1 1 1 1  0  13 o 0 56.5349  0.350697  -2.68733e-17 -0.146292    0            0            225.024    -90          89.8284   -90          
1 1 1 1  0  14 o 0 69.6807  0.420811  -0.618577    7.57539e-17  0            0            275.269    0            47.5203   180          
1 1 1 1  0  15 o 0 41.778   0.275831  1.38471e-17  0.0452279    0            0            163.746    -90          24.9824   90           
1 1 1 1  0  16 o 0 69.6139  0.418371  -0.346991    4.24942e-17  0            0            270.606    180          7.78079   -180         
1 1 1 1  0  17 o 0 17.4155  0.164949  2.73542e-18  0.00893457   0            0            65.3514    90           18.1716   90           
1 1 1 1  0  18 o 0 7.36206  0.126836  0.0953224    0            0            0            1.08764    0            3.06624   -2.84705e-13 
1 1 1 1  0  19 o 0 2.07364  0.311307  1.85627e-18  0.00606305   0            0            0.833983   -90          11.9514   90           
1 1 1 1  0  20 o 0 10.0698  0.132315  0.189879     0            0            0            39.3351    0            22.3837   180          
1 1 1 1  0  21 o 0 9.75192  0.131521  1.86043e-17  0.0607663    0            0            37.4203    90           3.06018   -90          
1 1 1 1  0  22 o 0 16.2265  0.143549  0.138466     0            0            0            69.2638    0            20.4706   180          
1 1 1 1  0  23 o 0 5.33854  0.233109  -9.08088e-18 -0.049434    0            0            9.79266    90           2.85877   -90          
1 1 1 1  1  0  o 0 41.0451  0.301108  1.0232e-16   0.334202     0            0            171.611    -90          6.22811   -90          
1 1 1 1  1  1  o 0 51.3962  1.73367   126.787      17.0922      -42.3993     -10.7514     244.975    45.1243      68.7134   -5.21193     
1 1 1 1  1  2  o 0 26.0503  1.09203   -34.7731     -47.358      4.57129      -14.3173     65.6385    -123.764     101.305   27.4528      
1 1 1 1  1  3  o 0 30.6594  3.90126   213.346      0.694309     89.1882      3.05046      178.299    -5.2549      87.1646   -24.7444     
1 1 1 1  1  4  o 0 49.7605  0.589155  -13.6721     12.6701      0.0154852    10.414       230.121    75.1034      55.4505   143.436      
1 1 1 1  1  5  f 1 18.761   0.484143  -28.0933     12.0042      -11.8569     12.1488      95.8936    -145.149     44.8978   -146.183     
1 1 1 1  1  6  o 0 84.9646  0.403423  -6.15904     -2.55818     -4.07454     -2.39651     398.119    -88.6831     53.3632   -123.292     
1 1 1 1  1  7  o 0 11.9004  1.11815   -135.962     -11.8641     -56.9227     -9.87838     68.4368    -158.414     71.3441   169.118      
1 1 1 1  1  8  o 0 11.7455  0.672704  -5.12324     -10.9705     2.03479      -2.47536     89.4394    -96.2618     129.983   -68.4808     
1 1 1 1  1  9  o 0 41.1192  1.689     -63.2562     6.44627      -20.1733     4.47679      178.833    -147.826     17.3905   -111.999     
1 1 1 1  1  10 o 0 109.42   0.697589  3.91326      0.604147     -1.28653     -0.0666542   470.359    73.4346      70.1105   59.2384      
1 1 1 1  1  11 o 0 19.184   0.121614  0.159809     -0.338673    0.129881     0.159888     62.0627    16.1084      17.41     -63.943      
1 1 1 1  1  12 o 0 40.3738  0.964899  -27.1132     -6.58346     -5.6273      -3.00292     85.1039    -163.095     145.233   31.6659      
1 1 1 1  1  13 o 0 59.2006  1.28057   -45.3957     -0.624596    -14.0658     -0.761302    224.704    146.809      17.206    -6.7768      
1 1 1 1  1  14 o 0 37.6972  0.204     -0.116866    -0.182635    1.0213       0.644369     166.877    23.175       44.4445   11.3211      
1 1 1 1  1  15 f 1 51.669   1.08446   30.2678      -3.3782      -11.4522     3.0084       188.279    40.317       31.8204   177.889      
1 1 1 1  1  16 o 0 31.3421  0.782996  24.5314      -3.97991     -5.53361     1.70135      111.061    2.15881      27.5384   -118.034     
1 1 1 1  1  17 o 0 36.362   0.187348  0.753441     1.21919      0.317832     -0.38721     143.357    83.015       0.740514  26.8135      
1 1 1 1  1  18 o 0 20.2552  0.154942  -3.79081     -3.82739     -0.689454    -6.42546     96.4044    147.922      43.9843   -175.417     
1 1 1 1  1  19 o 0 51.2053  1.32204   62.4116      -4.49147     -20.3036     1.99257      210.179    -48.5446     43.6841   17.0167      
1 1 1 1  1  20 o 0 52.069   0.407685  -0.923575    4.23921      0.968868     0.593536     231.193    83.0098      56.6622   82.3593      
1 1 1 1  1  21 o 0 32.8089  0.783997  -50.4007     3.14847      -26.2396     4.5212       112.696    -125.969     37.3782   97.5507      
1 1 1 1  1  22 o 0 15.1997  0.339591  5.58583      -0.179941    -2.26875     0.362695     54.0697    47.165       17.8968   -116.599     
1 1 1 1  1  23 o 0 22.0303  0.232139  0.0423892    0.460763     -0.244283    -0.0841701   104.915    43.8795      28.6888   51.639       
1 1 1 1  2  0  f 1 43.8942  0.35704   8.17485e-17  0.267011     0            0            188.395    90           77.7635   90           
1 1 1 1  2  1  o 0 32.7199  1.23569   29.7894      -114.494     48.7224      26.4846      205.312    -2.17189     165.99    29.523       
1 1 1 1  2  2  o 0 80.4959  1.04463   4.3113       -39.0373     26.48        3.38019      350.395    -19.0676     41.0382   -124.407     
1 1 1 1  2  3  o 0 54.3507  0.361656  4.05641      1.06797      -3.2406      -1.27375     259.323    91.8019      84.8546   34.1822      
1 1 1 1  2  4  o 0 24.7797  2.05318   47.1708      220.363      59.6784      -26.4123     152.885    82.3384      140.324   42.9407      
1 1 1 1  2  5  o 0 57.5149  0.397618  -2.51955     -21.543      31.9643      -3.46084     247.801    176.385      116.033   85.9735      
1 1 1 1  2  6  o 0 14.0321  0.454     12.5547      -17.6372     2.64226      7.79227      47.256     -45.252      21.5405   -136.967     
1 1 1 1  2  7  o 0 45.8043  1.17227   8.25314      -60.6837     20.863       6.22252      206.307    -130.286     109.554   155.213      
1 1 1 1  2  8  o 0 52.1892  0.923615  1.57096      -27.774      13.0356      1.93707      228.918    -144.035     24.2419   175.575      
1 1 1 1  2  9  o 0 73.2587  0.307064  -0.248037    -1.56018     1.60865      -1.81797     329.266    -34.2969     45.698    -30.6185     
1 1 1 1  2  10 o 0 46.0026  0.827441  7.86821      11.4583      1.16156      -3.25212     205.785    31.6516      58.246    53.7069      
1 1 1 1  2  11 o 0 49.6395  0.382753  0.811893     -13.2535     13.1765      0.937281     198.372    -15.3634     32.5083   -93.414      
1 1 1 1  2  12 o 0 74.1965  0.33538   -0.058062    0.51931      0.693105     1.46372      330.089    62.7548      87.2636   44.1713      
1 1 1 1  2  13 o 0 43.837   0.330025  -2.67851     7.41601      4.4701       4.25343      210.468    179.424      155.314   129.551      
1 1 1 1  2  14 o 0 36.0838  0.688259  -5.20645     -22.1501     10.98        -6.00147     129.494    -47.9997     58.2578   -154.394     
1 1 1 1  2  15 o 0 33.2975  0.182472  -0.63188     -3.11322     5.77561      -1.53899     149.261    -15.7871     45.7631   -34.7056     
1 1 1 1  2  16 f 1 23.4109  0.233666  3.69115      8.16712      5.06516      -5.11549     79.2667    3.2041       35.4487   121.501      
1 1 1 1  2  17 o 0 21.8251  1.60191   -6.34664     119.121      28.3609      2.78327      86.2429    99.2645      30.1921   -178.364     
1 1 1 1  2  18 o 0 31.4619  1.0275    3.93584      -31.3323     7.09354      2.07299      129.746    -91.966      12.6304   -87.4124     
1 1 1 1  2  19 o 0 39.9128  0.185861  3.43633      -3.84717     0.0459593    2.24364      179.917    33.6352      53.5765   9.51243      
1 1 1 1  2  20 o 0 51.0116  0.939636  -5.28937     -47.0625     18.1494      -2.92867     198.822    -148.589     40.975    -62.7483     
1 1 1 1  2  21 o 0 37.7188  0.792962  9.67482      18.794       4.39054      -5.40056     130.855    19.3351      28.4244   -172.127     
1 1 1 1  2  22 o 0 23.0966  0.14202   1.08548      3.03579      1.62715      -2.37335     99.0131    143.976      22.7767   71.572       
1 1 1 1  2  23 o 0 21.2783  0.914471  1.87887      -6.96429     1.91841      0.585988     100.498    -99.7615     27.2774   -90.8385     
1 1 1 1  3  0  o 0 29.599   0.249584  -1.00492e-16 -0.547051    0            0            126.817    90           26.1443   90           
1 1 1 1  3  1  f 1 13.9096  0.741021  47.0277      28.5649      -11.4171     -22.2794     51.4985    -14.5745     5.01147   -24.8262     
1 1 1 1  3  2  o 0 32.3783  1.17806   42.7701      12.2747      -12.242      -7.92519     152.3      21.6518      50.9462   18.1518      
1 1 1 1  3  3  o 0 38.4054  1.12111   62.0144      1.99306      -24.5504     -2.05416     138.289    -53.8675     73.1825   162.227      
1 1 1 1  3  4  o 0 27.5328  1.43777   122.667      -23.1012     -42.163      16.8615      129.818    52.6477      89.7631   119.882      
1 1 1 1  3  5  o 0 22.3277  0.529547  10.0069      -21.3952     9.32162      11.6904      130.797    -128.203     67.4647   -121.87      
1 1 1 1  3  6  o 0 30.2249  0.140277  -5.79407     0.567833     -94.0966     -1.8333      165.354    -100.635     83.9508   -136.397     
1 1 1 1  3  7  o 0 47.692   0.590112  -10.4572     -6.32664     -1.84344     -3.92139     185.93     -163.388     30.9179   60.9025      
1 1 1 1  3  8  o 0 64.4077  0.669003  -6.80241     -0.786152    -2.02331     -0.704415    296.876    -146.748     56.7637   -147.693     
1 1 1 1  3  9  o 0 85.8076  0.39673   -1.07384     1.49033      -0.157031    1.30884      396.191    171.786      77.2675   179.553      
1 1 1 1  3  10 o 0 53.6708  0.231005  -1.02059     -0.525758    -16.0279     0.229763     235.613    -96.8775     89.2893   -150.918     
1 1 1 1  3  11 o 0 67.0903  0.286513  -0.00567035  -0.964477    0.689203     0.0317915    266.316    27.9708      27.8443   -42.2059     
1 1 1 1  3  12 o 0 29.6293  2.03848   -198.623     1.52244      -48.1923     0.906131     101.442    -167.393     78.4494   -68.7698     
1 1 1 1  3  13 o 0 27.6127  0.384674  -7.50313     -3.36556     -1.37822     -1.48992     71.2436    -172.026     80.1365   -35.3437     
1 1 1 1  3  14 o 0 18.387   0.106931  0.357573     -0.107491    -0.263663    0.400409     68.5725    43.5622      7.21681   72.4279      
1 1 1 1  3  15 f 1 27.7712  0.579827  11.1384      -7.99824     -1.31161     3.65701      90.6483    -5.65955     40.913    -135.56      
1 1 1 1  3  16 o 0 35.9924  1.93431   101.183      -7.11969     -23.3918     3.65797      142.757    0.381848     14.8016   -23.4932     
1 1 1 1  3  17 o 0 56.0884  0.83097   0.524624     -7.48946     1.26094      0.40425      247.403    -120.736     53.1791   -103.736     
1 1 1 1  3  18 o 0 30.4932  0.291199  -20.6898     -1.32529     -17.3509     -3.47078     133.627    117.51       49.5493   170.042      
1 1 1 1  3  19 o 0 8.24306  0.510339  -21.8569     2.89785      -9.56075     2.4644       16.9842    111.205      26.0343   6.00137      
1 1 1 1  3  20 o 0 9.65765  0.340305  -3.82738     5.5061       0.814838     2.0908       37.5755    94.2883      20.3532   161.445      
1 1 1 1  3  21 f 1 28.9687  0.925203  17.2926      -4.59032     -5.23018     3.64411      140.185    33.0404      38.3479   17.629       
1 1 1 1  3  22 o 0 14.5413  1.44732   52.0387      -6.52987     -13.8965     3.19053      50.3975    -26.7844     21.643    122.058      
1 1 1 1  3  23 o 0 7.74388  0.464264  0.478834     0.784983     0.0747445    -0.113384    19.1929    55.4516      19.2857   -125.305     
1 1 1 1  4  0  o 0 51.1214  0.335226  -6.92556e-17 -0.37701     0            0            223.886    -90          29.8708   90           
1 1 1 1  4  1  o 0 14.1     1.65141   -4.4029      250.591      81.5741      3.71059      98.1133    64.7375      125.661   40.4741      
1 1 1 1  4  2  o 0 18.6481  0.122264  1.59598      -3.34189     2.95849      4.03065      81.5403    -156.608     83.2653   162.346      
1 1 1 1  4  3  o 0 15.6095  0.102244  1.51661      1.30872      -0.10371     -0.678438    61.494     36.1776      24.7965   47.7407      
1 1 1 1  4  4  o 0 30.7569  0.179809  6.23482      2.102        -2.91571     -1.99013     108.246    78.2193      50.7945   -120.223     
1 1 1 1  4  5  o 0 18.7201  0.533842  -3.82774     -109.001     140.484      -11.3158     102.942    -143.277     98.0247   -92.6654     
1 1 1 1  4  6  o 0 59.8166  0.384078  -1.80737     -0.0472891   -1.51263     -0.164839    216.082    120.093      72.9952   -45.891      
1 1 1 1  4  7  o 0 28.137   1.9294    -3.40592     -87.1242     23.4986      -1.99761     131.847    -87.3465     37.8293   -91.1429     
1 1 1 1  4  8  o 0 14.5703  0.384311  2.61829      4.60234      0.772865     -1.36205     62.7966    58.0388      41.9775   103.129      
1 1 1 1  4  9  o 0 51.1267  0.224173  0.0373619    -1.78506     3.24205      1.24938      210.067    -157.538     41.9596   140.604      
1 1 1 1  4  10 o 0 38.22    0.173421  -1.79887     1.05012      -0.842331    2.07052      172.388    -127.092     95.9058   -178.463     
1 1 1 1  4  11 o 0 51.2586  1.97495   -4.60682     -114.773     34.6261      -2.47896     224.206    -89.8649     67.341    -91.4203     
1 1 1 1  4  12 o 0 70.7525  0.310756  -2.03342     -1.2468      -0.794289    -0.972329    352.662    -74.8676     154.865   -80.8185     
1 1 1 1  4  13 o 0 35.4119  1.22942   -8.81876     -48.223      11.7551      -4.21336     162.767    -103.933     59.332    -107.996     
1 1 1 1  4  14 o 0 33.6964  0.476447  -4.89007     6.61635      0.481716     1.90027      171.715    111.529      91.5184   113.207      
1 1 1 1  4  15 f 1 47.6605  1.02395   2.21175      29.3689      7.28597      -0.895334    216.103    57.3785      73.4661   75.5203      
1 1 1 1  4  16 o 0 17.4131  0.147204  -5.97446     -1.1768      -2.23365     -0.949311    82.734     -127.064     66.6106   -177.447     
1 1 1 1  4  17 o 0 46.3004  0.658208  0.226073     -22.4221     32.9431      -3.79588     184.296    -15.8672     39.5191   -101.267     
1 1 1 1  4  18 o 0 8.5202   0.136681  -2.75798     -0.278363    -1.07501     -0.252984    27.2657    -146.171     29.3691   130.131      
1 1 1 1  4  19 o 0 28.2484  0.193248  0.683184     -2.38782     4.59778      1.58976      105.309    4.14818      27.2772   -97.6635     
1 1 1 1  4  20 o 0 22.5768  0.327137  -0.484639    -3.95173     3.10225      -1.18046     80.9447    -170.224     10.752    35.1833      
1 1 1 1  4  21 o 0 30.4185  0.169135  -1.54756     -3.1416      6.33419      -2.86496     140.725    -18.4776     27.4972   -31.3207     
1 1 1 1  4  22 o 0 18.6603  0.154482  0.299567     -0.25516     -0.644635    -2.10954     63.9535    -67.3674     36.353    61.1229      
1 1 1 1  4  23 o 0 14.4076  0.225589  -1.03345     -2.54242     5.15372      -0.567002    81.4085    -175.675     46.4318   -170.609     
1 1 1 1  5  0  o 0 69.6391  0.394093  3.49376e-16  1.14115      0            0            306.786    90           7.50776   90           
1 1 1 1  5  1  o 0 29.7907  0.618446  -11.5018     18.2524      3.26615      6.52646      65.9893    90.5746      127.741   -106.735     
1 1 1 1  5  2  o 0 10.3338  0.333749  -34.7096     0.522084     -36.0163     0.85776      35.1227    -176.676     50.0337   163.149      
1 1 1 1  5  3  f 1 11.3976  0.240299  -9.29029     1.30133      -9.31038     2.81432      54.7467    13.2482      132.089   -14.3785     
1 1 1 1  5  4  f 1 28.9531  0.548752  43.2078      5.18595      -35.7109     -9.4951      56.6074    -42.8358     157.132   97.7988      
1 1 1 1  5  5  o 0 87.2142  0.675457  3.07053      4.75862      1.14271      -1.37374     392.022    -0.178739    52.8992   27.8854      
1 1 1 1  5  6  o 0 35.9785  1.86155   78.7565      -7.64011     -31.0863     5.75868      135.238    -51.1516     42.9627   86.5212      
1 1 1 1  5  7  o 0 73.551   0.508756  8.32045      -4.20709     -1.23097     1.86023      304.492    3.72564      13.8893   -112.333     
1 1 1 1  5  8  f 1 52.1907  1.08952   -16.4337     8.60048      -1.69052     2.61405      121.584    154.74       169.022   -23.7413     
1 1 1 1  5  9  o 0 48.0456  0.245367  -0.450611    0.339432     -9.17081     -2.90442     173.516    102.565      50.0616   -131.297     
1 1 1 1  5  10 o 0 22.1583  1.32605   -96.4378     -1.90082     -30.8142     -1.33913     71.8899    149.98       24.9194   -42.9141     
1 1 1 1  5  11 o 0 13.1585  0.209612  3.25276      4.25404      0.612949     -2.29151     54.3399    48.4413      43.3882   58.0124      
1 1 1 1  5  12 o 0 21.0607  1.62776   -150.933     16.6007      -43.9656     9.65772      43.1275    157.195      75.1368   -42.3446     
1 1 1 1  5  13 o 0 46.5808  0.282499  8.09985      -2.29647     -9.08267     4.03753      108.359    -82.8697     160.937   63.0263      
1 1 1 1  5  14 o 0 26.0959  0.142652  -0.116092    -2.34146     0.789043     -0.131056    105.794    -50.5282     19.4911   -61.7343     
1 1 1 1  5  15 o 0 26.2001  0.47732   20.4301      6.53015      -6.00701     -4.46174     86.6207    -20.1173     36.6148   106.397      
1 1 1 1  5  16 o 0 10.4728  1.43753   151.091      -2.89355     -41.9224     1.48875      37.1448    -6.92856     7.1675    -118.055     
1 1 1 1  5  17 o 0 51.9085  0.823968  2.29654      -4.93754     1.62585      1.19064      229.462    -88.6852     51.1139   -88.6941     
1 1 1 1  5  18 f 1 60.3126  1.24532   -24.2687     2.24341      -12.6429     4.1417       265.798    -140.501     73.1601   -109.713     
1 1 1 1  5  19 o 0 23.9654  0.128249  -2.56114     0.799855     -1.06753     0.628018     115.107    72.4418      58.9901   100.186      
1 1 1 1  5  20 f 1 10.1198  0.0881125 -0.116028    0.138393     -0.109318    0.552336     20.8259    -53.0617     26.2017   139.943      
1 1 1 1  5  21 o 0 18.5165  0.140723  -0.146872    0.207901     0.521615     0.130633     67.9947    166.528      15.9703   -35.1434     
1 1 1 1  5  22 o 0 25.9667  1.97973   26.0268      -1.16603     -5.5512      1.37976      129.911    -0.0454605   48.2085   7.82239      
1 1 1 1  5  23 o 0 22.2132  0.411916  -0.776999    1.02176      0.246167     0.233367     84.4497    -171.104     11.4982   37.3387      
1 1 1 1  6  0  o 0 59.6791  0.334916  7.23971e-17  0.236467     0            0            262.923    -90          6.39417   -90          
1 1 1 1  6  1  o 0 32.5821  1.28235   -17.8522     -121.747     56.0621      -17.4097     168.094    -30.1492     77.4214   14.7456      
1 1 1 1  6  2  o 0 59.867   0.29362   -0.209807    1.28825      7.38219      -3.52111     274.032    164.953      54.797    -156.061     
1 1 1 1  6  3  f 1 54.4234  0.282997  1.15141      -0.165525    -0.275537    0.0612829    258.072    30.387       62.7272   27.1267      
1 1 1 1  6  4  o 0 33.2692  1.35208   -7.34839     42.5761      12.2255      4.14596      156.788    77.8977      46.5628   102.529      
1 1 1 1  6  5  o 0 82.9949  1.02928   -0.996176    -14.0054     10.3874      -0.255706    380.137    -152.313     113.755   153.743      
1 1 1 1  6  6  f 1 14.5287  0.479085  -5.51759     -4.86386     -0.239383    -1.75232     36.4229    -109.148     84.3198   -20.2964     
1 1 1 1  6  7  o 0 67.6166  1.36311   4.92458      32.1195      6.63703      -2.27999     227.593    84.6633      80.6965   -95.988      
1 1 1 1  6  8  o 0 65.6     0.70832   1.47721      6.17051      14.852       -3.6879      329.077    -2.66054     162.564   -29.9233     
1 1 1 1  6  9  o 0 54.6814  0.578688  -4.46165     2.89985      -1.25589     2.17156      236.174    100.248      50.2713   83.4216      
1 1 1 1  6  10 o 0 33.133   1.07424   8.33889      -61.8685     18.3181      4.90706      89.0174    -55.0481     79.3304   139.595      
1 1 1 1  6  11 o 0 10.8228  1.17971   -2.02015     -94.7565     25.2676      -1.11214     47.4069    -150.582     100.082   160.807      
1 1 1 1  6  12 o 0 52.9026  0.298864  -0.797949    -1.13616     1.8767       -2.13829     193.693    -148.136     44.905    96.1601      
1 1 1 1  6  13 o 0 35.9775  0.84026   11.8553      15.961       2.30476      -6.71978     137.413    9.4063       78.7945   92.0716      
1 1 1 1  6  14 o 0 45.5593  0.813453  -0.777266    -26.8532     19.8081      -0.0800042   199.736    -156.011     76.2045   -112.016     
1 1 1 1  6  15 o 0 7.1208   0.39311   2.89787      -16.3628     6.31896      2.36059      38.3774    -87.0283     45.0899   -110.55      
1 1 1 1  6  16 o 0 50.7534  0.323114  -0.838975    0.468745     2.42771      2.52978      236.353    -157.884     72.4243   -159.85      
1 1 1 1  6  17 o 0 17.6222  0.583156  2.42241      33.0036      27.698       -4.90139     61.8028    162.337      18.3239   -59.2906     
1 1 1 1  6  18 o 0 18.5068  0.506993  11.0573      22.1819      5.73873      -7.20917     56.1909    22.5131      33.5588   169.579      
1 1 1 1  6  19 o 0 5.18157  0.303538  -2.71968     -12.1561     5.99684      -2.75224     4.48924    -179.596     20.2842   75.6962      
1 1 1 1  6  20 o 0 18.956   0.742178  0.711716     13.2742      2.59792      -0.175499    76.5351    94.7513      9.09695   -9.47782     
1 1 1 1  6  21 o 0 26.1288  1.08068   1.0958       -12.9237     3.8422       0.295922     116.769    -48.7333     18.6917   -55.3138     
1 1 1 1  6  22 o 0 8.7897   0.620633  -2.26957     0.371396     -0.403772    0.0637773    38.2088    130.041      21.5738   -177.124     
1 1 1 1  7  0  o 0 16.4073  0.108981  -1.19036e-17 -0.0648003   0            0            46.8709    -90          2.18896   -90          
1 1 1 1  7  1  o 0 49.4287  0.419981  -10.3113     4.08431      -5.18387     4.25039      191.683    95.79        43.1179   -127.135     
1 1 1 1  7  2  o 0 61.0388  0.907506  7.88993      -2.33181     -1.60217     0.920325     306.113    -45.5133     103.14    -37.8757     
1 1 1 1  7  3  o 0 39.2567  1.23375   44.6452      -0.893127    -19.4899     1.10478      182.992    55.6754      43.9737   89.666       
1 1 1 1  7  4  o 0 39.2977  0.326653  -3.14713     -2.37315     -0.540692    -3.19931     128.856    148.455      73.0923   -8.85452     
1 1 1 1  7  5  o 0 54.4884  0.323142  -0.212293    0.141889     -2.54341     -1.19733     228.03     -85.3139     41.3615   -34.0955     
1 1 1 1  7  6  o 0 36.2919  0.172557  2.16512      -0.229841    -5.03658     2.06011      177.126    68.7142      97.8064   29.3566      
1 1 1 1  7  7  o 0 61.1646  1.60097   26.4966      -5.24564     -6.61046     2.55009      246.362    -27.7815     12.8971   -25.6749     
1 1 1 1  7  8  o 0 57.6243  0.436901  -2.72245     5.66269      1.70387      2.52751      228.142    49.6903      45.217    129.366      
1 1 1 1  7  9  f 1 97.1567  0.799265  18.5559      -2.36793     -19.5534     1.94034      390.525    -79.4823     38.19     -21.2606     
1 1 1 1  7  10 o 0 11.4827  0.575273  12.4571      8.30946      -1.00359     -2.42112     7.87344    93.24        78.6542   -158.075     
1 1 1 1  7  11 o 0 65.1406  0.527821  5.4386       0.624356     -1.41584     -0.516546    279.119    -71.6159     62.6495   -38.9163     
1 1 1 1  7  12 o 0 45.4317  0.472301  -5.89886     1.58684      -1.45392     0.948892     150.83     143.789      46.7861   -37.6407     
1 1 1 1  7  13 o 0 31.5941  0.311188  -15.6714     1.96159      -31.1822     5.49273      110.056    83.2196      46.7682   -30.4029     
1 1 1 1  7  14 o 0 38.4167  0.602183  1.11238      -11.6921     2.27641      0.56393      159.821    -94.1854     32.5783   -87.5208     
1 1 1 1  7  15 o 0 47.4102  0.763901  -35.152      0.47075      -15.6386     -0.405825    212.843    126.894      91.2344   177.928      
1 1 1 1  7  16 o 0 4.88643  0.569696  -18.0552     -4.90374     -5.47559     -3.263       38.5156    161.381      71.5915   135.611      
1 1 1 1  7  17 o 0 34.3609  0.25729   1.04451      -3.55102     0.630778     0.484105     149.121    -7.34137     37.4273   -30.6364     
1 1 1 1  7  18 o 0 5.38398  0.784792  31.5832      -12.9738     -8.21299     8.21825      22.828     -22.2984     14.1436   -42.3178     
1 1 1 1  7  19 o 0 33.9221  0.961631  -30.5783     5.87371      -12.897      5.87103      135.505    -143.34      38.2507   -78.7538     
1 1 1 1  7  20 o 0 16.283   0.447536  -0.382425    -1.05101     0.127783     -0.115576    68.9175    -81.2693     8.45198   -102.44      
1 1 1 1  7  21 o 0 12.6434  0.743749  -3.70187     -1.28983     -1.29607     -0.543755    40.4411    -149.996     20.3359   3.55665      
1 1 1 1  7  22 o 0 22.9018  0.237603  1.75977      -1.11721     -2.20213     0.191804     104.718    -88.2959     26.4652   -72.5263     
1 1 1 1  8  0  f 1 8.73499  0.0850298 5.15264e-19  0.00168298   0            0            21.736     -90          54.9286   90           
1 1 1 1  8  1  o 0 58.4327  0.673256  2.6874       5.80107      1.29064      -1.82166     235.881    30.3472      8.55635   9.13736      
1 1 1 1  8  2  o 0 17.2817  1.62704   -8.97693     -65.4599     17.6585      -5.0085      91.9193    -95.0312     58.6311   -82.5701     
1 1 1 1  8  3  o 0 37.7231  0.221211  -2.29669     0.0302858    -0.753722    -0.0146529   111.896    -154.058     69.4743   25.3158      
1 1 1 1  8  4  o 0 70.5207  1.84519   1.38961      40.6288      11.5842      -0.337991    250.243    54.4303      71.4988   -158.855     
1 1 1 1  8  5  f 1 38.1214  0.330736  -0.369963    0.212213     -0.0657329   0.138271     112.322    -87.8776     71.6969   107.838      
1 1 1 1  8  6  o 0 70.4153  0.563531  -0.612463    -0.486689    0.0722603    -0.265312    335.288    170.531      118.627   171.3        
1 1 1 1  8  7  o 0 19.1564  0.104082  0.60719      0.175776     -0.423487    -0.234194    55.7628    -5.04915     4.42068   -128.983     
1 1 1 1  8  8  o 0 69.7592  0.50353   -0.150388    23.7978      27.7901      -1.77207     263.629    165.264      21.3909   9.27095      
1 1 1 1  8  9  o 0 47.9337  0.212052  0.746302     -0.0314769   -3.36131     -2.26656     168.652    103.651      43.8197   -112.832     
1 1 1 1  8  10 o 0 72.3621  0.370655  -2.57437     -15.9879     12.6153      -2.60222     260.311    -171.41      80.5203   -51.0684     
1 1 1 1  8  11 o 0 48.3638  0.501075  2.85124      4.42395      0.274935     -0.559008    193.142    59.0595      14.8626   53.7846      
1 1 1 1  8  12 f 1 38.5515  0.276002  0.408642     -4.41946     3.80125      0.422354     184.857    -156.709     77.7714   -162.513     
1 1 1 1  8  13 o 0 31.7637  0.432574  -9.5204      3.39041      -2.93178     2.05603      152.113    114.608      68.949    125.911      
1 1 1 1  8  14 o 0 25.7582  0.736164  -5.07367     -74.5142     59.6768      -9.50124     138.497    177.961      100.297   141.715      
1 1 1 1  8  15 f 1 39.049   0.444233  -4.5803      0.987312     -0.972573    0.401452     158.668    160.482      12.2121   160.975      
1 1 1 1  8  16 o 0 35.5361  0.174792  0.922617     -2.61558     8.85741      1.5983       140.834    -0.299819    30.6612   75.8658      
1 1 1 1  8  17 o 0 16.5741  0.127597  0.0778316    -1.02098     1.02568      0.0421736    38.4807    -11.9887     48.0881   -177.165     
1 1 1 1  8  18 f 1 23.8865  0.451684  -4.95742     -19.2603     9.10714      -4.36424     82.0049    -163.696     33.1363   80.3778      
1 1 1 1  8  19 o 0 20.3324  0.165312  -0.148072    -0.436951    -0.0611874   -0.977026    97.5589    -79.0525     32.4706   -58.7903     
1 1 1 1  8  20 f 1 15.4719  1.20237   0.524015     27.4779      9.16477      -0.678871    52.6024    107.304      22.6561   -114.03      
1 1 1 1  8  21 o 0 7.09131  0.613163  -1.48102     1.5854       0.114283     0.475013     12.4089    145.037      27.8599   -23.3332     
1 1 1 1  9  0  o 0 24.1122  0.152482  -4.94279e-18 -0.0269073   0            0            92.7373    -90          20.8024   -90          
1 1 1 1  9  1  f 1 72.948   0.466807  -2.08944     0.00329634   -2.86625     1.20394      291.181    111.982      50.8129   26.9518      
1 1 1 1  9  2  o 0 49.2332  0.245864  -0.0654566   0.350994     0.338789     0.203268     190.116    2.68548      14.6459   114.206      
1 1 1 1  9  3  f 1 56.0845  1.14754   46.4755      1.01708      -18.9322     -1.27455     198.963    56.3016      98.098    168.708      
1 1 1 1  9  4  o 0 68.883   0.465874  -2.0706      3.77657      0.56325      1.22758      301.077    144.87       60.5375   143.903      
1 1 1 1  9  5  o 0 63.3083  0.780023  -13.6924     2.32054      -3.85999     1.5487       303.679    -155.157     112.432   -157.45      
1 1 1 1  9  6  o 0 71.9976  0.471354  -1.00915     0.134961     -1.17687     0.0363822    289.875    142.799      26.9261   94.4008      
1 1 1 1  9  7  o 0 57.0736  0.412992  -2.44582     0.259964     -6.37807     -0.119686    210.386    96.1213      28.5603   -84.6211     
1 1 1 1  9  8  o 0 44.3823  0.539546  6.873        10.4871      1.09352      -2.73289     147.592    76.2799      50.7662   -81.746      
1 1 1 1  9  9  f 1 35.1935  2.17895   138.185      -14.9736     -36.6679     8.44918      165.456    -9.57862     64.733    -2.0289      
1 1 1 1  9  10 o 0 25.0287  0.614432  19.9839      -10.1961     -4.87231     6.49224      76.4198    -71.2392     40.1775   132.849      
1 1 1 1  9  11 o 0 19.5875  0.767486  -20.4335     4.14879      -3.97024     1.63868      82.0609    167.677      20.1126   175.348      
1 1 1 1  9  12 o 0 56.9085  0.604627  19.0294      -0.129277    -6.14658     -0.490816    226.574    -45.3677     26.7286   -6.57091     
1 1 1 1  9  13 o 0 26.9555  0.733522  69.3331      4.15372      -34.9213     -4.8982      118.963    55.4369      44.613    2.13197      
1 1 1 1  9  14 o 0 3.07608  0.290314  -1.10674     -5.85546     2.73535      -1.10013     21.1808    -152.045     44.1803   -173.331     
1 1 1 1  9  15 o 0 27.7462  1.28576   -80.4691     2.38776      -27.7141     2.14319      91.8876    -138.605     32.3121   34.526       
1 1 1 1  9  16 o 0 3.92571  0.672669  6.85211      -8.04352     0.299594     1.8056       26.1872    -154.244     68.6523   -176.003     
1 1 1 1  9  17 o 0 37.0756  0.205043  -0.0956298   0.143019     0.0145002    -0.0851754   150.921    -144.484     19.9455   -147.491     
1 1 1 1  9  18 o 0 12.9005  0.377682  -2.05808     -3.03884     0.257728     -0.527381    26.3071    -148.362     51.6245   -18.8696     
1 1 1 1  9  19 o 0 27.7206  1.54962   -47.2566     7.04039      -9.14778     2.38731      125.807    175.789      27.9384   148.039      
1 1 1 1  9  20 f 1 11.2044  0.156665  -0.223393    -0.37737     0.269487     -0.0997307   42.9948    -139.738     3.69128   137.443      
1 1 1 1  9  21 o 0 3.53553  0.481386  -0.0401449   0.169787     0            0            9.28216    -166.981     35.2617   -158.091     
1 1 1 1  10 0  o 0 67.5411  0.379847  -1.83269e-17 -0.099767    0            0            270.278    -90          42.3374   -90          
1 1 1 1  10 1  o 0 40.0079  0.393787  3.16341      -9.2708      1.74741      1.3917       189.091    -34.7685     93.8187   -73.4819     
1 1 1 1  10 2  o 0 25.7499  1.30745   7.59862      65.8041      16.4986      -3.94656     73.7438    89.6153      72.3793   -145.818     
1 1 1 1  10 3  f 1 75.2981  1.21874   -5.63365     0.458073     -0.465882    0.101797     303.735    -160.511     22.6065   131.604      
1 1 1 1  10 4  o 0 14.1357  0.223362  1.49252      17.9783      31.2759      -5.60685     73.9774    47.6591      104.07    93.2619      
1 1 1 1  10 5  o 0 32.6985  1.11602   9.04674      34.8046      8.97604      -4.85017     94.0827    57.7606      63.1653   -122.543     
1 1 1 1  10 6  o 0 34.6612  0.224179  0.0071372    -0.0440752   -0.00412681  -0.0326162   154.148    169.112      51.6615   168.871      
1 1 1 1  10 7  o 0 40.599   0.373114  1.46213      -8.55631     6.09433      1.60451      156.181    -12.215      68.8227   -99.8834     
1 1 1 1  10 8  o 0 22.6388  1.88556   -10.9382     94.1427      20.1752      4.89317      102.556    93.827       34.8018   71.0422      
1 1 1 1  10 9  f 1 54.8687  0.337564  1.66611      1.82472      -0.319221    -1.49199     255.809    97.504       90.0091   101.169      
1 1 1 1  10 10 o 0 31.9859  0.27486   -3.40444     -15.8085     14.418       -7.32658     135.972    -25.4934     31.7155   5.67623      
1 1 1 1  10 11 o 0 8.83527  1.4358    22.8601      139.736      35.1252      -11.8893     66.2113    44.3078      100.412   14.1347      
1 1 1 1  10 12 o 0 45.2958  0.490237  -5.86074     6.98495      0.990315     3.47957      194.777    83.0908      33.1833   77.6423      
1 1 1 1  10 13 o 0 12.0896  0.669033  -9.47671     30.9544      13.1399      8.58315      54.2564    165.191      14.4103   171.691      
1 1 1 1  10 14 o 0 44.3361  1.41803   -3.4267      -52.3641     15.7926      -1.33449     161.22     -130.453     26.2137   21.5305      
1 1 1 1  10 15 o 0 7.40482  0.408921  -7.87025     -6.00845     -0.991224    -3.46411     56.2265    -131.414     77.1189   -151.628     
1 1 1 1  10 16 o 0 21.2292  0.142707  0.0977009    3.29424      5.45195      -1.30597     99.516     165.079      38.9719   154.566      
1 1 1 1  10 17 f 1 6.98365  0.294974  -0.813602    -13.5877     10.9605      -1.5581      47.3629    -112.966     113.119   -140.437     
1 1 1 1  10 18 o 0 33.9283  0.766507  -0.520531    12.2794      3.41596      0.722375     155.564    75.551       32.4167   68.1878      
1 1 1 1  10 19 o 0 14.3089  0.187709  -0.20471     0.393288     -0.0910724   0.323481     70.751     106.844      30.9273   100.93       
1 1 1 1  11 0  o 0 45.0955  0.259066  4.7585e-17   0.155424     0            0            181.369    90           70.5011   90           
1 1 1 1  11 1  o 0 12.4695  0.330177  6.93181      -0.443903    -2.46927     0.330667     22.4139    -3.32259     34.1065   -175.878     
1 1 1 1  11 2  o 0 19.6665  0.64889   8.40656      6.07986      -0.73326     -2.13808     89.0257    37.6536      41.7766   7.2742       
1 1 1 1  11 3  f 1 79.6501  0.363956  -6.98062     -0.186923    -3.00227     -0.790009    344.856    -119.578     57.3499   -120.213     
1 1 1 1  11 4  o 0 64.883   1.02495   10.3328      -4.38081     -1.35412     1.20337      304.701    0.32037      99.303    -7.88905     
1 1 1 1  11 5  o 0 40.4865  0.548701  6.11966      -2.62149     -1.8392      2.34167      177.966    32.8422      41.5647   22.1175      
1 1 1 1  11 6  o 0 39.4742  0.682097  -21.4035     1.50368      -11.209      2.01466      174.342    114.158      41.0419   111.061      
1 1 1 1  11 7  o 0 26.3187  0.581174  9.3532       4.26808      -1.84867     -2.26466     67.0451    40.4536      64.9403   -135.042     
1 1 1 1  11 8  o 0 40.3814  0.275174  4.82622      1.37078      -2.59251     -2.14859     164.951    -46.9843     21.0008   -57.4725     
1 1 1 1  11 9  o 0 51.9744  0.364602  -9.97215     0.62149      -5.81227     1.67859      224.466    104.658      53.9519   121.271      
1 1 1 1  11 10 o 0 41.8035  1.40613   -39.1502     12.4877      -9.89923     6.42422      161.638    156.665      15.0339   42.5459      
1 1 1 1  11 11 o 0 15.7275  0.362821  -5.37711     6.35091      0.390686     2.20431      21.262     131.163      79.1722   -80.7232     
1 1 1 1  11 12 o 0 18.1283  0.315663  20.1888      1.3786       -31.9884     -2.4796      83.4971    95.7416      44.79     146.494      
1 1 1 1  11 13 o 0 28.4081  0.774259  23.5115      10.6844      -5.87402     -6.2499      110.058    64.2968      4.06371   -23.9265     
1 1 1 1  11 14 o 0 22.4648  0.151327  -0.465504    -0.333703    0.345636     -2.17597     94.2061    -47.9023     20.0281   -23.2653     
1 1 1 1  11 15 o 0 11.7841  0.285227  -12.1969     0.918274     -11.025      1.2569       61.8689    117.108      47.0169   152.392      
1 1 1 1  11 16 o 0 16.8874  0.672867  30.0743      -6.14603     -12.0766     4.88571      71.9274    -63.0194     17.2003   -53.8343     
1 1 1 1  11 17 o 0 12.2464  0.101211  0.528777     0.457558     0.490877     -1.10375     57.6982    -36.1386     30.5705   7.73401      
1 1 1 1  11 18 o 0 20.2123  0.970099  -6.67564     -1.63795     -1.66094     -0.415139    76.9734    -173.304     10.6899   -24.3766     
1 1 1 1  12 0  o 0 7.58288  0.0783127 4.76292e-18  0.0155569    0            0            10.7487    90           12.6705   -90          
1 1 1 1  12 1  o 0 49.06    1.40127   0.390955     -24.9051     5.01328      0.0291331    217.247    -80.0151     49.0036   -88.6179     
1 1 1 1  12 2  o 0 9.15181  0.492446  -0.333011    10.5002      1.95331      0.140073     30.9973    -151.018     117.443   -124.615     
1 1 1 1  12 3  o 0 15.1726  0.383719  2.79022      -0.208447    -0.795272    0.146723     79.579     19.935       72.7809   8.62         
1 1 1 1  12 4  o 0 33.4279  0.400605  -0.54098     -1.87738     1.05017      -0.775281    145.982    -145.909     40.236    -165.045     
1 1 1 1  12 5  o 0 24.158   1.02415   7.1066       40.8474      16.2267      -6.11923     117.735    41.704       82.7313   87.7681      
1 1 1 1  12 6  f 1 44.4302  0.277605  0.246656     0.00962012   -0.235766    -0.537097    154.485    -74.7332     34.5975   85.569       
1 1 1 1  12 7  o 0 33.1005  1.05348   -5.34573     39.5171      14.8461      3.56564      173.386    145.921      85.7291   162.826      
1 1 1 1  12 8  o 0 15.3148  0.715801  10.0843      -14.4013     1.11205      3.19374      27.3523    -53.5003     63.8313   120.397      
1 1 1 1  12 9  o 0 7.11061  0.211445  1.87021      3.95196      1.75493      -2.04606     10.6809    57.8264      19.0977   177.145      
1 1 1 1  12 10 o 0 32.4985  0.254403  2.03219      3.33155      0.542982     -1.91485     125.241    4.69018      7.48984   -128.146     
1 1 1 1  12 11 o 0 39.5064  1.28826   3.18087      45.3817      19.5273      -1.76392     158.821    32.7385      7.43911   9.57819      
1 1 1 1  12 12 o 0 62.9606  0.365588  1.26664      0.24018      -0.666885    1.4885       247.184    63.3913      7.59075   -4.39792     
1 1 1 1  12 13 o 0 18.7164  0.323327  2.04352      -19.0611     20.0413      3.2298       34.2471    -11.3433     76.1194   173.016      
1 1 1 1  12 14 o 0 18.4501  0.215938  1.5156       -6.88349     3.42548      1.37205      78.6978    -15.4378     28.1717   -61.1        
1 1 1 1  12 15 o 0 26.037   0.638303  3.62378      9.14333      1.38016      -1.55838     99.2069    112.788      24.514    33.0939      
1 1 1 1  12 16 o 0 23.0213  0.280468  1.20463      -0.228644    -0.281861    0.0711677    81.4874    -58.773      25.4777   113.194      
1 1 1 1  12 17 o 0 7.91554  1.0772    -0.045062    -11.7237     4.05391      0.305302     22.5438    -124.717     16.0267   75.0354      
1 1 1 1  13 0  o 0 47.9698  0.295239  -6.9163e-17  -0.376506    0            0            190.224    90           68.5925   -90          
1 1 1 1  13 1  o 0 32.7163  0.259882  0.163126     0.0471738    0.0566492    0.434957     124.094    42.3096      3.9374    -110.801     
1 1 1 1  13 2  o 0 39.2171  0.187317  4.16489      1.58176      -1.75823     -2.10529     186.272    103.649      80.5082   75.7175      
1 1 1 1  13 3  o 0 36.66    0.224011  0.47588      0.445924     0.00495667   -0.0237937   168.747    121.618      44.1804   111.765      
1 1 1 1  13 4  o 0 6.16543  0.129224  1.90706      -0.0405796   -6.62423     0.714961     16.3043    161.953      36.8962   -172.346     
1 1 1 1  13 5  f 1 31.0907  0.221131  -0.434581    0.230304     0.591929     1.32362      154.267    -164.301     66.6198   -147.222     
1 1 1 1  13 6  o 0 15.9194  1.39912   101.64       -6.75312     -31.4675     4.41145      68.9203    -17.0859     28.5831   19.4617      
1 1 1 1  13 7  o 0 12.9202  0.115033  -0.0751559   0.128556     2.14596      0.283242     73.3447    -176.881     51.2413   174.295      
1 1 1 1  13 8  o 0 18.8619  0.144833  4.18093      0.534074     -4.20371     -0.624636    97.0192    -70.0922     48.0869   -55.9053     
1 1 1 1  13 9  f 1 24.6447  0.176344  -0.322617    -0.361501    -0.0443895   -0.114831    87.4163    -68.2289     17.0338   124.718      
1 1 1 1  13 10 o 0 4.71482  0.921002  38.4982      -4.83268     -14.3315     3.57927      23.014     -19.3387     25.1954   -46.3569     
1 1 1 1  13 11 f 1 11.1849  0.497264  3.63335      10.8032      2.63624      -1.9289      19.7638    62.8776      41.6128   -123.799     
1 1 1 1  13 12 f 1 11.0388  1.1484    94.3119      7.76035      -40.8329     -7.12902     58.0662    -48.4555     39.1593   -54.8412     
1 1 1 1  13 13 o 0 8.57871  0.514845  2.41807      9.96533      2.26469      -1.1255      24.1153    74.3141      17.1205   -155.732     
1 1 1 1  13 14 o 0 21.5135  0.174113  -0.589932    -0.282026    -0.235102    -0.161334    89.9047    65.1913      8.4341    129.813      
1 1 1 1  13 15 o 0 10.576   0.194879  0.419055     0.483735     0.0140935    -0.104955    49.1888    -0.262558    26.5615   10.3766      
1 1 1 1  13 16 f 1 12.567   0.674137  -6.63962     0.113395     -3.33255     -0.558364    66.5931    -138.2       42.6083   -134.775     
1 1 1 1  13 17 o 0 5.19615  0.392587  -0.125581    0.0897447    0            0            6.51751    -127.134     14.2029   83.8708      
1 1 1 1  14 0  o 0 21.8906  0.145215  -5.43932e-18 -0.0296103   0            0            88.1106    90           36.5728   90           
1 1 1 1  14 1  f 1 17.4502  0.576696  1.93018      18.8906      9.0684       -2.0806      98.6207    32.2355      62.6964   44.6284      
1 1 1 1  14 2  o 0 13.3602  0.383182  -2.11808     -4.27236     1.04474      -1.41672     37.1315    -124.933     17.4626   43.7067      
1 1 1 1  14 3  o 0 3.57595  0.209606  0.995859     0.775578     -0.0370021   -0.156848    2.95864    105.162      17.1854   -165.706     
1 1 1 1  14 4  o 0 30.695   0.245772  0.614819     -0.505       0.589845     0.937149     94.2024    -30.8624     59.7981   132.246      
1 1 1 1  14 5  o 0 45.4908  1.47945   -2.24176     -30.549      6.95482      -1.43462     202.63     -67.6624     41.8076   -85.2762     
1 1 1 1  14 6  o 0 28.69    0.573596  6.47866      4.17504      -1.07023     -1.94725     137.888    23.9724      50.963    25.8503      
1 1 1 1  14 7  o 0 13.1076  0.147691  -0.296375    7.33851      14.8547      2.28183      78.5879    7.13903      55.4548   -2.58344     
1 1 1 1  14 8  o 0 28.0077  0.548375  2.87976      9.30205      1.99117      -1.54636     105.686    65.4474      7.10779   -138.646     
1 1 1 1  14 9  o 0 20.1179  0.407079  0.903847     -3.4429      1.52807      1.07618      78.8922    -57.5322     9.55572   -26.7961     
1 1 1 1  14 10 o 0 41.4662  0.489789  -4.83668     4.43192      -0.00259974  1.26397      179.258    -156.055     46.3028   170.735      
1 1 1 1  14 11 o 0 30.598   1.46179   2.7725       -64.8997     22.9752      2.72016      112.895    -131.58      14.934    -2.10849     
1 1 1 1  14 12 o 0 21.3263  0.216643  -3.45891     0.478669     -1.32669     0.637411     96.4286    128.52       34.2064   126.054      
1 1 1 1  14 13 o 0 34.0916  0.810969  0.204218     16.0213      4.05101      -0.533113    153.704    116.671      23.8058   110.963      
1 1 1 1  14 14 o 0 17.929   0.372838  -0.899209    -3.92182     1.01251      -0.640316    84.6937    -127.421     24.8268   -124.703     
1 1 1 1  14 15 f 1 29.8757  0.530555  0.770116     2.48545      1.06744      0.148439     133.598    82.2941      24.5367   71.0246      
1 1 1 1  14 16 f 1 22.5479  0.244402  1.07191      -0.326844    0.49142      0.792107     81.8349    7.28017      18.0403   169.61       
1 1 1 1  15 0  o 0 6.49615  0.106012  8.77753e-18  0.0286696    0            0            25.6264    -90          52.8541   90           
1 1 1 1  15 1  o 0 33.3804  0.22577   1.17305      -1.15852     -0.891912    1.60301      156.224    65.0992      47.3539   43.9024      
1 1 1 1  15 2  o 0 25.4468  0.468358  -6.25878     0.194455     -1.01297     -0.00259792  121.444    -140.182     48.0506   -168.684     
1 1 1 1  15 3  o 0 20.9105  0.797528  -11.5691     -1.71959     -3.36887     -0.87992     108.927    172.726      58.0184   175.128      
1 1 1 1  15 4  f 1 24.872   0.596855  -4.46556     -1.495       -1.64219     -0.989038    92.4983    -161.851     10.2578   -0.615837    
1 1 1 1  15 5  o 0 32.5908  0.438307  -0.372883    -1.73405     0.492188     -0.284222    112.397    -75.1898     32.8607   102.658      
1 1 1 1  15 6  o 0 38.5099  0.430432  -10.3221     -0.158475    -8.22526     1.30899      177.001    -116.912     56.4665   -91.2136     
1 1 1 1  15 7  o 0 20.8376  0.720095  -16.7328     9.97637      -2.58184     4.52495      84.0309    140.824      9.40471   135.012      
1 1 1 1  15 8  o 0 21.961   0.154046  -0.950937    0.459723     -0.576615    1.30901      83.3745    -142.163     7.44132   -35.4132     
1 1 1 1  15 9  o 0 13.0224  1.03072   -43.4054     -3.4426      -10.7838     -1.85283     55.2985    178.598      15.732    -152.383     
1 1 1 1  15 10 o 0 32.873   0.926794  20.736       3.03473      -5.3534      -1.12501     118.336    48.491       26.9404   -73.1731     
1 1 1 1  15 11 o 0 26.3836  0.186645  0.181064     1.34736      1.0066       -1.67796     122.524    -27.5024     26.3492   -10.1937     
1 1 1 1  15 12 o 0 35.548   0.791413  20.0238      2.66853      -6.53783     -1.02873     141.387    54.1337      19.6905   -76.7976     
1 1 1 1  15 13 o 0 26.8791  0.209371  -0.300491    -0.757898    -0.543593    0.56224      114.08     118.916      8.66759   93.0999      
1 1 1 1  15 14 o 0 19.4278  0.168378  0.177182     -0.0215919   0.0842746    -0.0393092   64.0274    14.8551      28.6597   -161.703     
1 1 1 1  16 0  o 0 18.2893  0.226812  -2.76373e-18 -0.015045    0            0            74.2517    -90          1.84292   90           
1 1 1 1  16 1  o 0 16.8948  0.161208  2.32244      5.35461      1.70823      -1.60869     57.5084    117.857      33.1819   2.4068       
1 1 1 1  16 2  o 0 10.3439  0.19581   0.731719     4.41822      8.50044      -3.63121     37.2203    -171.696     40.6787   -85.9592     
1 1 1 1  16 3  o 0 57.7208  0.472303  0.0788812    -0.386588    -0.0787344   0.0999425    247.723    179.818      34.5879   -177.501     
1 1 1 1  16 4  o 0 20.4393  0.207379  1.45441      -7.50306     3.9327       1.99018      92.1064    -144.214     39.9548   -95.8536     
1 1 1 1  16 5  o 0 18.2212  0.191591  -0.147484    -0.442551    3.2366       0.24268      55.0635    -175.374     36.8645   -30.1374     
1 1 1 1  16 6  o 0 27.5127  0.259817  -0.321725    -0.909318    0.0145491    -2.21416     99.725     -25.1066     32.0589   -137.892     
1 1 1 1  16 7  o 0 23.7143  0.242785  -1.06954     -2.43408     1.65578      -0.96447     109.007    -40.2128     36.4139   -37.6904     
1 1 1 1  16 8  o 0 19.9403  1.24106   0.64922      24.6762      6.33964      -0.0175395   70.2614    72.9872      27.0131   -105.319     
1 1 1 1  16 9  o 0 19.1832  0.347982  2.49347      -1.92514     -0.105095    0.907024     85.8068    32.7209      27.7999   -25.9166     
1 1 1 1  16 10 o 0 20.4749  0.485306  3.33883      -7.29608     2.06155      1.98223      73.9472    -45.2662     23.0627   114.239      
1 1 1 1  16 11 o 0 24.7983  0.692366  0.840874     4.3689       2.25243      0.543083     97.4463    27.2662      11.0024   -174.496     
1 1 1 1  16 12 f 1 14.8075  0.298787  0.654071     0.969207     0.0169627    -0.362279    74.1247    104.864      31.4404   100.53       
1 1 1 1  16 13 f 1 14.26    0.239102  -0.307312    -0.913221    0.136638     -0.3085      45.8045    -18.4047     25.4787   -161.62      
1 1 1 1  17 0  o 0 12.0789  0.163354  8.28501e-18  0.0270609    0            0            53.6816    -90          14.1815   90           
1 1 1 1  17 1  o 0 14.9991  0.462632  -7.85354     2.40679      -2.12053     1.24608      67.7965    -159.815     18.4379   137.875      
1 1 1 1  17 2  f 1 11.3929  0.455718  -1.32645     2.64476      0.466499     0.533737     37.3062    92.5641      21.7993   -118.502     
1 1 1 1  17 3  o 0 24.7284  1.05179   16.7086      2.48431      -5.43303     -1.15951     115.482    35.3644      21.2627   65.604       
1 1 1 1  17 4  o 0 15.8096  0.176162  0.0213771    0.320717     0.263862     -0.274202    59.7987    99.7628      13.8098   -109.546     
1 1 1 1  17 5  o 0 10.998   0.169209  0.552958     0.413505     -0.104877    -0.262056    42.259     124.647      14.5788   30.0251      
1 1 1 1  17 6  o 0 8.63655  0.473417  -4.91962     1.64666      -1.17158     0.785847     42.9972    -177.816     32.1855   139.313      
1 1 1 1  17 7  f 1 5.2393   1.00215   20.4018      -3.35738     -5.51597     1.78154      36.2848    -16.0955     39.5424   -39.2378     
1 1 1 1  17 8  o 0 13.3229  0.246831  0.233557     -0.0166342   0            0            56.4279    -2.0317      5.49182   -2.86688     
1 1 1 1  17 9  o 0 26.3055  1.24648   -11.7721     -1.9659      -2.79767     -0.279513    121.72     -165.267     25.7749   -153.983     
1 1 1 1  17 10 o 0 7.8805   0.511615  1.89654      0.841992     -0.385788    -0.613015    26.7213    -18.8073     16.3797   87.9586      
1 1 1 1  17 11 o 0 23.6382  0.414124  0.977696     0.833423     0.188048     -0.197278    104.528    11.34        17.06     13.7459      
1 1 1 2  0  0  o 0 54.5628  0.450782  -0.447975    5.48611e-17  0            0            230.026    180          24.7874   -180         
1 1 1 2  0  1  o 0 32.2227  0.202003  -3.93338e-17 -0.214123    0            0            115.365    -90          86.4119   -90          
1 1 1 2  0  2  o 0 19.6723  0.131286  -0.156889    1.92133e-17  0            0            86.3219    180          15.316    -0           
1 1 1 2  0  3  o 0 127.816  0.711121  -6.80088e-17 -0.370223    0            0            583.463    -90          0.408372  90           
1 1 1 2  0  4  f 1 55.1516  0.332522  0.503413     0            0            0            251.372    0            3.85983   7.53433e-14  
1 1 1 2  0  5  o 0 28.6705  0.216355  9.40203e-17  0.307094     0            0            129.868    -90          20.326    90           
1 1 1 2  0  6  o 0 5.77061  0.102151  0.0759746    0            0            0            7.25162    0            30.525    180          
1 1 1 2  0  7  o 0 13.3192  0.133793  1.29452e-17  0.0422823    0            0            11.9722    -90          7.05128   90           
1 1 1 2  0  8  o 0 32.4684  0.29604   0.0251587    0            0            0            138.268    0            60.5775   0            
1 1 1 2  0  9  o 0 21.3963  0.217443  -1.21911e-17 -0.0663654   0            0            90.7387    -90          31.7276   90           
1 1 1 2  0  10 o 0 8.98332  0.147826  -0.0340168   4.16586e-18  0            0            11.3893    0            25.7463   180          
1 1 1 2  0  11 o 0 21.7371  0.23213   -1.31174e-18 -0.00714081  0            0            53.0742    90           22.7515   90           
1 1 1 2  0  12 o 0 29.4958  0.238772  -0.122077    1.49501e-17  0            0            116.144    180          38.5616   -180         
1 1 1 2  0  13 o 0 66.1755  0.429389  -1.43984e-17 -0.0783814   0            0            264.073    90           31.2284   90           
1 1 1 2  0  14 o 0 41.8497  0.270647  -0.0386618   4.7347e-18   0            0            165.59     0            11.4447   180          
1 1 1 2  0  15 o 0 48.3839  0.307033  3.87939e-17  0.126711     0            0            189.767    -90          13.6757   -90          
1 1 1 2  0  16 o 0 21.0903  0.159993  0.25139      0            0            0            81.9548    0            22.0561   180          
1 1 1 2  0  17 o 0 9.07193  0.12503   2.74644e-17  0.0897055    0            0            19.1691    90           8.14417   -90          
1 1 1 2  0  18 o 0 44.3035  0.283708  0.603156     0            0            0            177.577    0            26.0945   0            
1 1 1 2  0  19 o 0 24.978   0.186764  -1.24032e-17 -0.06752     0            0            99.1016    90           14.2201   90           
1 1 1 2  0  20 o 0 27.0555  0.225424  -0.0531489   6.50887e-18  0            0            106.216    180          4.7319    -180         
1 1 1 2  0  21 o 0 20.3002  0.166121  -2.5335e-17  -0.137918    0            0            78.8296    -90          16.1785   90           
1 1 1 2  0  22 o 0 23.5393  0.174995  -0.476702    5.83792e-17  0            0            99.9873    180          29.1666   -180         
1 1 1 2  0  23 o 0 47.1402  0.609379  -1.09257e-16 -0.594768    0            0            197.911    -90          10.6466   -90          
1 1 1 2  1  0  f 1 47.9239  0.282118  -0.643096    7.87565e-17  0            0            198.13     180          82.8982   -180         
1 1 1 2  1  1  o 0 19.0279  1.55416   -289.666     48.3908      -145.104     49.2699      99.0554    79.4492      108.399   30.505       
1 1 1 2  1  2  o 0 69.426   0.527041  -15.1124     8.42083      -3.84461     7.57698      329.792    -146.081     162.295   148.407      
1 1 1 2  1  3  o 0 16.8713  0.0917898 -1.13718     -2.00313     4.13437      -8.88483     72.7999    -62.9836     84.3582   -87.2331     
1 1 1 2  1  4  o 0 33.9353  1.17907   -39.879      -51.3163     5.24398      -21.8734     123.652    -165.949     58.9584   -9.46827     
1 1 1 2  1  5  o 0 25.7171  0.457419  60.7038      1.00035      -88.6857     -4.60895     137.985    99.9254      93.7329   152.074      
1 1 1 2  1  6  o 0 20.8228  0.826402  -8.76662     51.1534      17.328       6.20387      64.2981    64.1933      56.2108   -137.171     
1 1 1 2  1  7  o 0 68.4713  0.333921  6.43849      -2.43416     -11.227      5.23561      323.242    -94.6629     38.8005   -100.614     
1 1 1 2  1  8  o 0 24.8485  1.08177   22.7012      -4.90113     -5.03268     2.34917      86.1485    -10.1847     34.777    -157.505     
1 1 1 2  1  9  o 0 16.783   0.798051  -12.5449     -9.11366     -1.20832     -3.83653     45.2765    -144.866     39.5374   32.3027      
1 1 1 2  1  10 o 0 41.2582  0.464622  -5.12009     -6.96594     1.80492      -4.77233     199.322    171.384      73.3436   179.929      
1 1 1 2  1  11 o 0 50.9425  1.07374   -31.5049     2.8514       -11.8001     1.80181      262.465    -139.173     123.693   -136.786     
1 1 1 2  1  12 o 0 96.1558  0.802761  3.34807      -6.14683     0.475937     1.0141       421.389    -70.6564     85.1402   -69.736      
1 1 1 2  1  13 o 0 8.68937  0.724002  36.791       -22.2516     -7.31384     14.0247      29.9177    -34.8883     15.0738   -77.54       
1 1 1 2  1  14 o 0 41.1896  0.394754  -7.89874     -5.86276     -2.21336     -5.57063     166.38     -81.4992     17.2256   -35.0363     
1 1 1 2  1  15 o 0 30.4602  0.161523  4.28799      0.370795     -5.47604     -1.52092     103.633    -69.2083     32.6291   76.6316      
1 1 1 2  1  16 f 1 7.11823  0.63712   12.9729      29.2938      6.8656       -7.5139      28.1666    64.8466      10.7712   64.8335      
1 1 1 2  1  17 o 0 26.1368  0.999941  88.5178      -11.0789     -36.0241     8.65189      153.84     -49.4038     111.099   -26.5352     
1 1 1 2  1  18 o 0 30.4771  0.154042  0.0300885    0.55008      1.7386       3.82715      117.961    39.2309      25.7286   -58.4149     
1 1 1 2  1  19 o 0 17.6008  0.111865  4.60634      -1.90812     -7.81977     6.23189      91.2499    -97.8189     48.115    -79.7522     
1 1 1 2  1  20 o 0 19.7939  0.59141   -17.5628     -6.48709     -4.02001     -3.61277     61.019     -155.02      27.1253   30.2884      
1 1 1 2  1  21 o 0 27.1761  0.13962   3.3773       1.04711      -11.4122     -3.35985     111.662    94.9576      22.5914   142.624      
1 1 1 2  1  22 o 0 23.2606  0.585643  2.60448      16.7811      5.63621      -2.35842     114.848    125.832      36.1181   120.071      
1 1 1 2  1  23 o 0 14.177   0.342279  4.86867      0.403676     -5.13202     1.31944      61.6214    64.5014      31.0024   -6.15917     
1 1 1 2  2  0  o 0 47.55    0.325835  0.583791     0            0            0            198.484    0            60.8653   180          
1 1 1 2  2  1  o 0 97.9767  0.986085  10.3506      10.9211      -0.846276    -6.61369     415.223    80.2582      48.3837   172.372      
1 1 1 2  2  2  o 0 19.5485  1.25821   -70.6032     -84.5198     6.29925      -35.6946     92.2077    -125.199     109.725   170.555      
1 1 1 2  2  3  o 0 81.5037  1.69365   -1.52002     -47.564      16.8504      0.0859598    394.182    -134.278     74.4603   -151.759     
1 1 1 2  2  4  o 0 45.6105  1.60223   51.8224      -73.9787     8.22903      24.0622      219.959    -78.8268     40.5124   -75.7279     
1 1 1 2  2  5  o 0 25.8933  1.16749   -66.7157     41.7869      -11.4007     24.134       93.6782    108.085      44.2164   -8.36274     
1 1 1 2  2  6  f 1 45.0541  0.719633  -10.5164     -39.4018     25.8527      -13.4685     220.067    -174.895     42.9944   164.973      
1 1 1 2  2  7  o 0 28.5217  1.31836   -32.7158     -80.4381     17.8911      -17.7459     159.644    -108.477     97.4103   -103.887     
1 1 1 2  2  8  o 0 47.936   0.212004  -0.734453    0.104393     -4.50164     -2.54247     207.529    108.216      124.358   32.2446      
1 1 1 2  2  9  o 0 60.6364  1.28442   -7.72735     32.0199      9.71818      5.35697      258.63     142.53       9.44206   166.882      
1 1 1 2  2  10 o 0 66.1255  0.282457  0.672949     -3.07995     3.54973      0.873571     328.558    -164.97      134.582   -157.049     
1 1 1 2  2  11 o 0 17.8518  0.218489  -5.0444      3.13974      -1.20589     2.42609      51.922     175.617      9.88993   -33.4255     
1 1 1 2  2  12 o 0 39.9636  0.865331  -13.9617     -29.2607     6.55023      -8.29022     139.881    -148.296     68.5049   -36.8866     
1 1 1 2  2  13 o 0 81.7417  0.383467  0.444908     7.60275      4.97134      -1.25143     292.01     8.10028      74.372    149.519      
1 1 1 2  2  14 o 0 5.07491  0.136301  -3.58722     -0.397079    -4.87966     -1.00068     8.70055    -127.644     25.1965   -93.7914     
1 1 1 2  2  15 o 0 46.9444  0.631585  6.40032      -20.7664     7.77403      5.88328      227.861    -122.494     99.4572   -138.552     
1 1 1 2  2  16 o 0 22.6239  1.0409    2.83212      -57.6809     14.6781      1.63268      87.5258    -94.1928     20.6459   -26.0228     
1 1 1 2  2  17 o 0 14.1789  0.831299  40.5431      3.90804      -9.11509     -1.86524     75.2797    -8.2261      69.7742   -49.7571     
1 1 1 2  2  18 o 0 26.4163  0.543265  -17.572      -28.5671     9.52431      -17.088      107.677    -174.702     57.2246   -98.8303     
1 1 1 2  2  19 o 0 24.6517  0.945472  6.92609      44.9136      12.6936      -3.73092     68.6664    54.7387      61.655    -158.627     
1 1 1 2  2  20 f 1 9.25473  0.101787  -0.276916    0.0966835    -2.15971     0.791121     43.3176    88.9272      31.5239   132.102      
1 1 1 2  2  21 o 0 28.4776  0.22297   3.38154      -3.98244     2.28917      5.10536      109.674    -130.448     9.55375   154.373      
1 1 1 2  2  22 o 0 33.5485  1.13599   -1.25416     -32.4951     8.3389       -1.20233     146.608    -60.8126     18.8998   -105.405     
1 1 1 2  2  23 o 0 20.9876  0.187438  0.726498     0.722469     -0.968238    -0.433285    106.37     -53.2343     42.2156   -56.7886     
1 1 1 2  3  0  o 0 20.969   0.191387  0.117653     0            0            0            88.5158    0            57.568    -180         
1 1 1 2  3  1  o 0 45.0317  1.81759   60.17        -45.4244     -6.36952     20.4847      220.517    -52.1769     71.7439   -70.092      
1 1 1 2  3  2  o 0 27.5274  2.18936   253.392      -41.6682     -76.0409     26.1534      92.2679    48.9653      102.665   155.79       
1 1 1 2  3  3  o 0 33.7052  1.369     10.8797      80.7659      20.711       -5.89922     175.961    92.7409      100.346   47.4165      
1 1 1 2  3  4  o 0 51.1459  1.36978   73.8894      15.7226      -27.2048     -11.3423     236.975    63.1237      35.2687   107.113      
1 1 1 2  3  5  o 0 32.3937  0.311987  20.5745      4.56668      -13.9403     -6.02206     148.966    79.993       14.1743   55.5887      
1 1 1 2  3  6  o 0 77.1994  0.320115  0.528331     -1.09064     0.189681     1.81034      361.178    24.7522      46.3303   38.4763      
1 1 1 2  3  7  o 0 43.2427  0.843252  -7.56885     10.5951      1.35314      4.14025      208.733    124.001      66.6542   121.546      
1 1 1 2  3  8  o 0 104.311  0.730495  -16.316      0.0138128    -10.7521     1.49442      391.272    -113.948     102.421   78.7644      
1 1 1 2  3  9  o 0 44.1897  0.997684  4.09829      17.0329      5.54863      -2.57725     179.326    101.456      23.292    147.496      
1 1 1 2  3  10 o 0 46.3732  1.38962   -36.0272     -2.43674     -9.51436     -1.10585     153.115    162.805      77.0969   -62.4889     
1 1 1 2  3  11 o 0 77.3027  0.33334   -2.86175     1.1044       -0.529498    0.607805     234.534    136.348      138.998   -44.92       
1 1 1 2  3  12 o 0 55.4944  0.79416   21.1319      -2.47588     -4.40855     1.16867      194.211    11.3969      52.0374   -130.487     
1 1 1 2  3  13 o 0 54.3281  0.640454  -3.92778     19.1772      8.09569      3.04136      193.718    154.497      50.3171   -71.7271     
1 1 1 2  3  14 o 0 23.7934  1.21555   -92.547      -0.239853    -33.6041     -0.440597    122.94     139.338      64.4066   155.04       
1 1 1 2  3  15 o 0 58.0978  0.494954  1.79514      2.66299      0.333514     -0.897213    285.108    14.3219      125.595   15.274       
1 1 1 2  3  16 o 0 28.3061  0.338477  11.6958      4.23164      -6.572       -4.95063     132.785    -43.479      58.2342   -1.61396     
1 1 1 2  3  17 o 0 13.7573  0.403372  16.8606      -7.78802     -6.7708      8.20792      48.1657    16.0073      43.2742   -77.8006     
1 1 1 2  3  18 o 0 21.9013  0.749257  -23.846      12.5998      -5.61877     8.69068      86.6023    -161.689     9.38029   123.651      
1 1 1 2  3  19 o 0 22.7237  0.187548  2.88044      -3.82469     3.19186      7.48786      107.3      25.6481      39.7197   36.642       
1 1 1 2  3  20 o 0 16.7085  1.42917   -101.445     2.14764      -28.2373     1.48526      70.5709    168.705      17.9004   -173.38      
1 1 1 2  3  21 o 0 14.7787  0.100825  -0.814339    -1.18856     -0.346777    -3.17319     63.353     -55.061      6.87284   -102.521     
1 1 1 2  3  22 o 0 8.12397  0.698552  -8.31949     -10.2064     0.684579     -3.82753     27.7651    -115.341     7.92194   97.8256      
1 1 1 2  3  23 o 0 28.2732  0.211206  -0.58018     -1.24025     -1.50091     1.57664      107.033    -140.772     27.918    -14.7592     
1 1 1 2  4  0  f 1 35.564   0.247124  -0.111575    1.3664e-17   0            0            152.147    0            3.58016   1.7963e-12   
1 1 1 2  4  1  o 0 31.0306  0.155045  1.72314      5.07602      27.1786      -14.8087     153.125    -32.5375     118.07    -92.2263     
1 1 1 2  4  2  o 0 34.2654  1.42882   74.7625      11.6052      -17.6209     -5.47772     130.814    11.5485      40.8067   -120.645     
1 1 1 2  4  3  o 0 59.7273  1.03817   1.38166      -82.6373     46.7478      -0.249456    310.293    -35.1548     149.902   -79.2787     
1 1 1 2  4  4  o 0 33.4397  0.167089  11.0147      -1.26379     -21.5492     7.57637      168.656    71.7254      45.1129   60.0025      
1 1 1 2  4  5  o 0 38.8821  0.960258  -0.531454    -38.3341     10.0764      -0.488549    157.108    -101.897     33.516    19.8329      
1 1 1 2  4  6  o 0 46.1794  0.760887  4.90821      -0.68112     -0.80312     0.168189     210.889    -6.77861     39.7605   -11.1576     
1 1 1 2  4  7  o 0 80.8641  2.16357   -1.21369     -33.997      8.11281      -0.220965    377.963    -118.788     81.5037   -97.2321     
1 1 1 2  4  8  o 0 43.6419  1.2127    24.6691      -3.63881     -6.91649     1.8982       234.713    -34.0713     112.349   -29.8752     
1 1 1 2  4  9  o 0 69.6344  0.710618  -3.01868     -16.4049     15.6575      -4.48649     255.311    -174.822     62.7412   53.7981      
1 1 1 2  4  10 o 0 63.5725  0.405665  2.39741      2.18408      -0.0861006   -0.985521    214.957    -3.68995     69.4762   169.891      
1 1 1 2  4  11 o 0 30.4379  0.520276  7.7363       8.47041      0.183955     -2.25785     90.4638    56.0076      71.6336   -71.4903     
1 1 1 2  4  12 o 0 56.1174  0.245358  2.55412      -2.31215     -0.120487    2.63904      216.174    29.9957      15.1686   -81.3397     
1 1 1 2  4  13 o 0 22.7316  1.71409   -0.0898339   109.773      25.8989      0.179163     132.95     89.5384      94.3419   98.7633      
1 1 1 2  4  14 o 0 18.3733  0.316525  -13.7306     0.627265     -9.83746     0.672328     88.4911    -111.12      37.6217   -99.6253     
1 1 1 2  4  15 o 0 41.5297  1.8101    -9.87507     -86.9442     21.299       -5.22818     191.83     -86.3807     69.1853   -90.0964     
1 1 1 2  4  16 o 0 6.66047  0.0990753 0.609119     0.214947     -1.1198      -0.640694    12.9297    135.784      63.0404   127.923      
1 1 1 2  4  17 o 0 43.5866  0.199654  -0.228546    -0.0931053   -0.065578    -0.17559     171.715    117.934      1.90963   -146.283     
1 1 1 2  4  18 o 0 27.6908  0.867728  -23.1974     -6.76266     -6.34807     -3.64287     129.816    166.173      46.5117   171.698      
1 1 1 2  4  19 o 0 38.7211  1.38459   16.7611      72.3008      19.6974      -10.4911     147.605    111.805      44.9478   20.3188      
1 1 1 2  4  20 o 0 28.0721  0.981386  25.6459      2.08048      -5.53967     -1.04397     90.9832    -17.9427     36.657    129.861      
1 1 1 2  4  21 o 0 7.20453  1.05833   1.97296      -31.9119     9.80753      1.35229      16.3694    -96.2606     21.3758   75.3709      
1 1 1 2  4  22 o 0 11.6344  0.238067  -0.016521    -1.04734     0.388042     0.161022     41.0554    -134.009     9.81656   42.5087      
1 1 1 2  4  23 o 0 10.3935  0.654752  -2.64955     -1.47664     -0.442682    -0.504213    29.6829    -159.948     21.7277   3.72592      
1 1 1 2  5  0  o 0 10.7889  0.0827816 0.0338026    0            0            0            12.5292    0            9.75074   -180         
1 1 1 2  5  1  o 0 31.8693  1.18744   -19.5541     -46.8876     8.52429      -8.88989     175.796    -105.467     98.2463   -132.797     
1 1 1 2  5  2  o 0 57.8689  1.96904   127.597      -6.27374     -44.376      3.44319      294.193    -47.4371     87.8949   -59.8641     
1 1 1 2  5  3  o 0 37.8216  1.4158    1.31691      -78.5498     20.4966      0.468298     130.322    -80.0831     62.3082   105.483      
1 1 1 2  5  4  o 0 24.2331  0.279909  22.9726      -4.02092     -54.3619     17.4358      123.779    59.777       75.2582   11.7065      
1 1 1 2  5  5  o 0 29.8854  0.244522  -2.70371     1.7072       -1.84089     3.35678      127.876    73.0467      11.3411   114.75       
1 1 1 2  5  6  o 0 37.9883  0.200679  1.00824      0.961893     -0.0992713   -1.03446     174.03     123.182      46.1986   90.2214      
1 1 1 2  5  7  o 0 13.5626  1.04677   -23.1821     -13.6408     -3.41213     -6.20134     26.5762    -77.2975     113.89    -9.31219     
1 1 1 2  5  8  o 0 109.49   2.11746   -21.7043     0.0730672    -6.6353      -0.596978    434.439    -175.289     7.41649   77.0882      
1 1 1 2  5  9  f 1 17.1468  0.851918  4.24789      -19.6514     5.79318      2.70155      78.8634    -82.8011     43.2669   -76.3118     
1 1 1 2  5  10 o 0 13.0115  1.51191   -114.88      66.6099      -17.1254     29.801       42.2803    145.161      15.2349   -3.09678     
1 1 1 2  5  11 o 0 30.8369  1.20995   -72.2126     4.13434      -18.1874     2.20245      185.499    175.13       139.772   -177.759     
1 1 1 2  5  12 o 0 30.0984  0.722192  19.8134      15.499       -2.10567     -9.0138      120.176    80.6046      17.0351   124.203      
1 1 1 2  5  13 o 0 14.2106  0.302463  9.48894      11.5873      2.97306      -13.3304     62.6959    -17.1442     19.8753   14.3443      
1 1 1 2  5  14 o 0 57.0096  1.82302   -68.4985     14.6812      -15.3681     7.37163      243.795    157.257      52.9902   173.218      
1 1 1 2  5  15 o 0 31.5144  0.705056  -13.2836     17.1597      1.2843       5.39355      129.634    151.163      37.6184   102.888      
1 1 1 2  5  16 o 0 9.38819  0.249731  -9.5091      3.62554      -8.95422     8.30704      24.4457    -100.695     32.0711   15.184       
1 1 1 2  5  17 f 1 28.2021  0.336507  2.81233      0.818706     -2.74033     -1.2041      142.396    78.8922      68.0542   90.0447      
1 1 1 2  5  18 o 0 51.0064  0.227165  -2.22512     1.06495      -5.20402     1.61195      210.431    74.3621      38.8118   123.671      
1 1 1 2  5  19 o 0 7.32637  0.783666  2.15982      35.1152      9.89091      -1.2792      31.3627    81.9292      17.7953   40.3732      
1 1 1 2  5  20 o 0 25.6924  1.593     114.096      -15.8412     -31.5182     9.41854      85.8464    18.3588      25.1545   170.514      
1 1 1 2  5  21 f 1 8.70306  0.790842  2.43285      -15.1702     3.56066      1.28485      31.2581    -80.507      24.7506   11.7203      
1 1 1 2  5  22 o 0 8.51321  0.634629  -2.87743     0.159645     -0.709417    -0.0256172   40.5597    168.49       20.873    169.083      
1 1 1 2  5  23 o 0 14.6034  0.632676  0.275563     0.959178     0.131015     -0.00542342  72.919     109.678      33.4089   104.543      
1 1 1 2  6  0  f 1 12.1655  0.0938033 -0.0559285   6.84927e-18  0            0            13.7639    0            12.6191   -180         
1 1 1 2  6  1  o 0 56.3529  1.08056   10.4557      -39.7021     8.41998      5.05431      200.165    -96.7814     137.964   15.2672      
1 1 1 2  6  2  o 0 64.1809  0.775121  -5.99718     3.83075      -1.64811     4.70946      286.989    -154.799     62.2471   -105.714     
1 1 1 2  6  3  o 0 12.5369  1.18775   -2.59719     62.4988      29.4597      2.32477      40.4867    86.3444      98.0985   16.8964      
1 1 1 2  6  4  f 1 55.6781  1.75265   25.8501      19.1278      -1.83252     -6.57825     203.021    22.0033      73.2246   162.306      
1 1 1 2  6  5  o 0 66.5111  0.839829  -7.17816     -5.45038     -0.814788    -5.10814     266.001    -179.125     72.4222   76.6801      
1 1 1 2  6  6  o 0 46.27    1.99932   0.242788     56.2406      14.3077      0.0893911    196.945    73.2183      41.8652   145.4        
1 1 1 2  6  7  f 1 100.813  1.27343   -3.05738     7.33326      1.74249      2.37897      457.918    85.765       116.515   79.6774      
1 1 1 2  6  8  o 0 67.2326  1.04703   9.95442      -9.10194     -0.118596    2.47917      331.639    -25.7753     137.466   -31.323      
1 1 1 2  6  9  o 0 47.9619  1.55579   -26.126      -57.9327     9.90786      -11.5073     151.88     -106.976     71.3013   88.0811      
1 1 1 2  6  10 o 0 5.2117   0.441465  -10.0815     -32.139      22.5967      -15.654      38.8323    -42.878      94.8169   -30.0645     
1 1 1 2  6  11 o 0 47.1301  0.88328   16.1255      3.82655      -4.17087     -2.15704     185.186    -5.05683     8.3637    -14.9615     
1 1 1 2  6  12 o 0 36.534   2.01772   3.9025       -91.4338     20.4932      1.98285      173.013    -94.297      74.2566   -67.676      
1 1 1 2  6  13 o 0 40.0613  0.910844  -9.15134     22.54        5.68537      5.18878      178.283    94.5057      54.3499   89.2828      
1 1 1 2  6  14 o 0 37.8986  0.539071  -12.1603     2.82434      -3.10563     1.76117      196.7      142.442      111.69    145.172      
1 1 1 2  6  15 o 0 56.3186  0.391881  1.6554       5.7549       5.67237      -6.85044     265.329    139.851      99.1618   170.045      
1 1 1 2  6  16 o 0 25.1789  0.531264  -8.83329     -24.2181     13.4031      -12.1268     122.465    -45.657      51.4114   -68.0924     
1 1 1 2  6  17 o 0 4.25369  0.437188  10.4106      -1.08842     -3.63806     0.813641     23.9737    32.6805      42.9682   65.7253      
1 1 1 2  6  18 o 0 15.2777  0.148185  -5.8605      10.0874      4.89185      9.63163      29.226     54.1457      59.8754   -140.183     
1 1 1 2  6  19 o 0 11.5391  0.719266  -8.82782     -42.1911     20.5024      -9.31901     59.1038    -33.3485     35.3052   -9.18891     
1 1 1 2  6  20 o 0 20.0323  0.119481  0.842548     0.603742     -4.27871     -1.88423     85.0229    -74.1094     23.6841   -149.398     
1 1 1 2  6  21 o 0 6.98287  0.465384  2.97223      10.5095      5.96852      -3.37717     28.7369    128.838      12.2946   51.9645      
1 1 1 2  6  22 o 0 8.95969  0.538981  1.27962      1.95731      0.174182     -0.725224    41.2001    64.6038      20.3296   68.1093      
1 1 1 2  7  0  f 1 57.2931  0.325411  -0.22061     2.70169e-17  0            0            240.542    0            25.3808   180          
1 1 1 2  7  1  o 0 59.4338  0.474649  9.78172      2.97604      -8.70233     -4.72678     240.552    89.7219      31.2254   -153.097     
1 1 1 2  7  2  o 0 54.3769  1.23173   21.9707      3.55129      -6.19702     -1.86152     214.613    16.4049      21.7158   168.449      
1 1 1 2  7  3  o 0 74.4719  1.35681   0.825591     -10.2482     1.67231      0.372741     332.492    -105.378     47.3304   -84.8686     
1 1 1 2  7  4  o 0 50.7242  0.693049  -8.83836     5.12352      -2.92767     4.47062      203.594    90.1544      22.6349   -141.751     
1 1 1 2  7  5  o 0 32.9275  0.701621  -28.4684     7.33561      -14.0122     8.07982      179.226    104.266      98.0051   108.661      
1 1 1 2  7  6  o 0 63.425   0.929611  0.952828     6.29375      2.14182      -0.601133    238.844    35.8016      22.3459   -156.357     
1 1 1 2  7  7  o 0 51.3011  1.18988   49.3733      1.74555      -22.3265     -2.01524     233.793    -53.4909     62.744    -53.3149     
1 1 1 2  7  8  o 0 21.2503  0.664744  23.5788      15.7583      -3.56884     -8.83695     57.6539    5.41407      45.4119   166.128      
1 1 1 2  7  9  o 0 58.5919  0.319967  3.69909      -2.72195     -0.431514    1.74098      235.484    18.1074      20.3926   -11.8361     
1 1 1 2  7  10 o 0 49.6796  0.868494  -8.82943     23.0769      5.91835      5.04592      155.168    100.299      72.6836   -74.0894     
1 1 1 2  7  11 o 0 69.0651  1.02182   -35.3623     5.50834      -19.7766     4.68273      263.617    -123.146     34.2112   128.291      
1 1 1 2  7  12 o 0 45.5515  0.624973  -4.48008     -16.9613     6.10144      -3.00694     182.211    -146.276     26.3026   160.006      
1 1 1 2  7  13 o 0 83.9801  1.33846   18.1359      2.74974      -4.71291     -0.996899    331.079    -0.0527682   18.6357   13.4555      
1 1 1 2  7  14 o 0 27.1256  0.160411  1.30744      -0.191012    -3.43333     3.28136      123.287    62.8587      37.6485   35.4801      
1 1 1 2  7  15 f 1 18.6869  0.405907  -14.9135     8.02723      -6.40419     10.3903      74.9902    73.7528      25.0819   -4.18888     
1 1 1 2  7  16 o 0 15.1738  0.116429  0.403427     -0.527439    3.62314      4.84308      66.6338    30.9544      25.8345   78.454       
1 1 1 2  7  17 o 0 15.0168  0.415841  -23.4225     1.89354      -23.5818     4.54039      50.2272    -89.6969     43.4909   10.5509      
1 1 1 2  7  18 o 0 16.9535  0.290108  -5.52849     -4.40229     -1.53869     -5.22756     61.9081    164.296      41.7624   110.703      
1 1 1 2  7  19 o 0 29.115   0.792747  -9.69589     -12.6312     0.990636     -4.72533     111.361    -176.423     22.5395   -97.2207     
1 1 1 2  7  20 o 0 9.36348  0.161796  -2.93371     0.250581     -5.41516     1.8251       50.384     90.4435      26.4501   96.223       
1 1 1 2  7  21 o 0 13.3539  0.486181  2.36545      -1.77754     0.142215     1.81356      56.5639    20.3731      7.35759   -4.3226      
1 1 1 2  7  22 o 0 5.22348  0.505896  -1.44876     1.72877      0.232147     0.657524     26.2641    129.159      29.1172   134.321      
1 1 1 2  8  0  o 0 7.0993   0.0835269 0.0296299    0            0            0            10.4363    0            35.725    180          
1 1 1 2  8  1  o 0 73.7627  0.387714  1.9165       -0.935309    -0.715227    1.37042      291.859    -93.8441     6.5333    174.137      
1 1 1 2  8  2  o 0 38.3548  1.15943   10.4049      -20.8419     3.62083      4.61873      140.818    -80.8351     47.1198   26.1804      
1 1 1 2  8  3  o 0 45.8981  0.494586  1.43097      -3.36623     0.966286     0.845371     185.737    -51.4114     17.7275   -26.5416     
1 1 1 2  8  4  o 0 76.2652  0.973089  2.2929       9.16312      2.30767      -1.47049     310.763    92.0309      20.5298   110.244      
1 1 1 2  8  5  o 0 42.3438  1.32327   30.6595      3.62907      -7.08884     -1.85461     190.038    -3.89562     54.7479   11.5085      
1 1 1 2  8  6  o 0 93.7489  0.435545  0.853622     14.3779      12.4615      -3.58035     410.025    157.659      85.7235   137.661      
1 1 1 2  8  7  o 0 66.0289  0.890537  11.3788      0.170616     -4.00866     -0.324638    283.071    41.7811      51.7697   44.0028      
1 1 1 2  8  8  o 0 54.5081  0.228458  -0.428049    -1.26648     4.41499      -1.56343     265.634    176.986      108.052   163.968      
1 1 1 2  8  9  o 0 41.4534  0.188217  0.650452     -0.164752    -0.772729    0.992065     179.263    57.9749      41.3434   51.8296      
1 1 1 2  8  10 o 0 27.0495  1.31812   -9.99576     -75.5344     23.4245      -6.55147     93.7006    -134.445     33.1064   104.913      
1 1 1 2  8  11 o 0 18.748   0.48218   17.3126      -2.03349     -10.0556     2.50977      53.628     46.5271      45.1291   -91.401      
1 1 1 2  8  12 o 0 36.2303  2.05349   -7.85824     -120.287     33.6943      -4.77403     172.571    -72.1418     71.98     -67.0404     
1 1 1 2  8  13 o 0 51.8878  0.239871  3.54027      0.818013     -3.78421     -0.28919     230.408    67.9502      56.7313   98.3623      
1 1 1 2  8  14 o 0 19.8587  0.108762  0.17745      -0.737639    0.545429     0.152654     40.3239    -3.4907      77.7682   -147.648     
1 1 1 2  8  15 o 0 21.3589  0.336569  6.35521      -0.574603    -2.08791     0.298856     74.1141    38.962       18.8924   -107.648     
1 1 1 2  8  16 o 0 4.53427  0.358062  2.53285      19.3979      22.2331      -6.19759     5.18299    104.062      10.6159   161.404      
1 1 1 2  8  17 o 0 43.6579  0.543514  15.8462      -2.47839     -6.75218     1.2465       155.333    -67.0918     34.6182   66.4662      
1 1 1 2  8  18 o 0 18.038   0.979957  0.0264199    52.1538      17.8321      -0.302585    45.9222    130.902      44.5542   -47.9065     
1 1 1 2  8  19 o 0 30.0474  0.781306  -2.20344     5.46426      0.67941      0.544469     142.436    113.629      37.2051   114.284      
1 1 1 2  8  20 o 0 10.5398  0.370756  4.88196      1.92091      -1.36521     -1.46814     41.6856    -17.6323     1.66362   -54.6439     
1 1 1 2  8  21 o 0 16.4111  0.495897  0.888336     1.53039      0.0315611    -0.701699    65.8175    126.638      11.3476   45.6179      
1 1 1 2  9  0  o 0 20.0674  0.131195  0.0621779    0            0            0            68.6695    180          7.00005   -180         
1 1 1 2  9  1  o 0 84.4571  0.689341  21.8477      -1.69454     -8.60683     0.791525     407.819    58.2349      168.163   31.88        
1 1 1 2  9  2  o 0 52.7505  0.269766  -1.32729     3.55835      0.660185     0.615175     222.411    160.285      40.4131   126.927      
1 1 1 2  9  3  o 0 29.0131  0.171205  0.0304124    0.33162      0.435887     0.0544618    101.574    -48.0503     27.2312   54.5476      
1 1 1 2  9  4  o 0 78.0745  0.420082  -1.04439     -1.5061      0.254987     -0.420098    323.878    -97.4915     34.5969   -100.803     
1 1 1 2  9  5  o 0 20.6679  1.44561   -117.438     20.1108      -35.0086     12.2332      106.288    163.385      106.532   -149.505     
1 1 1 2  9  6  o 0 62.5938  0.804907  -1.54181     14.8201      3.19637      0.580618     186.199    61.9095      137.491   -150.815     
1 1 1 2  9  7  f 1 18.447   1.32492   131.4        -12.5674     -39.0565     7.63537      27.7053    11.7059      81.7951   -158.408     
1 1 1 2  9  8  o 0 42.369   0.303991  1.99481      -2.19644     -0.980701    5.60264      118.521    45.578       99.5809   -159.852     
1 1 1 2  9  9  o 0 33.9394  0.416485  4.68541      5.27367      0.444079     -2.45646     118.121    -6.33809     52.1803   106.94       
1 1 1 2  9  10 o 0 19.5193  0.401933  13.1123      12.0396      -0.699344    -10.8172     133.774    -11.2205     130.286   4.64226      
1 1 1 2  9  11 o 0 21.3282  1.74256   -143.4       3.32677      -43.5213     2.24795      82.9875    -160.798     39.1586   120.597      
1 1 1 2  9  12 o 0 41.4903  0.184349  0.595827     0.768017     11.0607      4.26013      234.78     11.3478      138.301   11.7249      
1 1 1 2  9  13 o 0 12.0236  1.13271   -76.7687     30.1645      -17.7415     16.6634      65.57      162.402      52.1043   -175.683     
1 1 1 2  9  14 o 0 24.7119  0.692055  16.2685      -2.79198     -4.29865     1.66978      113.474    22.0401      37.6622   5.99506      
1 1 1 2  9  15 o 0 19.0362  0.915982  -34.5978     0.374813     -8.13566     0.0469182    80.0952    176.782      16.2434   176.165      
1 1 1 2  9  16 o 0 26.9072  0.80087   -10.4775     -22.8019     3.97878      -4.39443     110.369    -91.3436     29.9063   -146.147     
1 1 1 2  9  17 o 0 9.41418  0.12147   6.14994      0.00585811   -30.3255     2.57819      18.2645    13.2198      70.0299   -64.594      
1 1 1 2  9  18 o 0 19.7646  0.501097  -0.245299    6.6411       3.02141      -0.10576     105.892    67.2977      56.0784   62.5381      
1 1 1 2  9  19 o 0 13.1708  0.865024  7.4942       2.22176      -1.17164     -0.685       73.635     12.0083      46.0957   18.2393      
1 1 1 2  9  20 o 0 23.9194  0.229847  -0.108839    -0.0298598   6.8246e-05   1.71549e-06  86.8716    125.222      19.3918   -56.6339     
1 1 1 2  9  21 o 0 11.649   0.22317   0.0770942    -0.422444    0            0            46.441     -54.7777     5.23279   -76.4269     
1 1 1 2  10 0  o 0 6.79706  0.0799709 -0.0237544   2.90907e-18  0            0            11.2039    180          44.9874   -4.58558e-14 
1 1 1 2  10 1  o 0 66.9767  0.313916  1.06363      0.250255     -1.67909     -1.89091     309.773    -83.0159     110.696   -54.5682     
1 1 1 2  10 2  o 0 35.7357  0.184213  0.0580183    -1.13644     4.65556      1.81378      188.478    -167.241     101.915   176.2        
1 1 1 2  10 3  o 0 46.3721  0.8114    -2.97846     -15.8746     4.07669      -1.70173     191.917    -117.581     23.985    -101.458     
1 1 1 2  10 4  o 0 19.3572  0.112825  -1.17972     3.2589       5.70425      5.29664      98.9581    -171.311     56.5309   171.476      
1 1 1 2  10 5  o 0 15.8459  0.568314  22.4259      -14.595      -3.62833     8.30879      61.4746    -31.4711     21.7201   -22.0897     
1 1 1 2  10 6  o 0 56.5951  0.738451  3.05949      13.2319      9.46927      -3.35987     226.572    10.9693      18.8109   -52.2235     
1 1 1 2  10 7  o 0 39.7551  0.211029  3.5884       4.09579      -0.21237     -9.11761     182.449    -36.7148     54.9483   -35.0446     
1 1 1 2  10 8  o 0 36.4114  1.11289   -18.4777     -18.2903     -0.188894    -5.58142     134.839    -132.608     9.75433   45.362       
1 1 1 2  10 9  o 0 6.42339  1.02279   -1.48361     -60.6631     20.1394      -0.941146    60.2019    -81.4034     86.7487   -68.9305     
1 1 1 2  10 10 o 0 7.28355  0.129365  -2.21543     8.52851      18.6056      9.79766      16.8762    156.071      19.0073   65.3478      
1 1 1 2  10 11 o 0 32.9679  0.472706  -15.7326     7.09899      -6.1196      7.63928      129.481    -143.44      11.4205   109.101      
1 1 1 2  10 12 o 0 33.7455  0.692625  1.70151      38.4781      22.4256      -2.77372     140.722    144.241      45.5866   76.0368      
1 1 1 2  10 13 o 0 64.3318  0.291866  1.85463      0.461933     1.31859      -5.95883     249.277    -35.5943     8.67936   140.562      
1 1 1 2  10 14 o 0 43.4757  0.216225  3.33269      0.569109     -2.18173     -0.165005    180.737    75.2104      23.933    65.19        
1 1 1 2  10 15 o 0 5.05596  0.277737  -3.40247     13.0069      10.8306      6.31765      12.8787    -83.8118     41.9219   -46.521      
1 1 1 2  10 16 f 1 32.6099  1.30471   -11.4755     49.6069      11.7537      6.23371      134.313    84.2406      20.8113   83.6016      
1 1 1 2  10 17 f 1 22.8014  0.354788  6.90937      -0.33174     -3.87348     0.952441     62.1435    -72.834      60.2502   60.135       
1 1 1 2  10 18 o 0 13.5744  0.446062  -2.17922     -9.60038     4.6591       -2.65125     71.6038    -47.1871     39.4418   -75.8305     
1 1 1 2  10 19 o 0 19.7762  0.425606  -0.453967    0.232755     0            0            87.2476    -13.3612     16.1939   -10.8927     
1 1 1 2  11 0  o 0 101.197  0.592876  -0.152951    1.87311e-17  0            0            404.89     180          3.93882   -1.98971e-12 
1 1 1 2  11 1  o 0 19.6338  0.839232  24.0293      -7.36893     -5.77741     4.01243      28.4142    -25.076      98.958    -165.494     
1 1 1 2  11 2  o 0 14.756   0.577332  24.8682      -11.9799     -7.02325     8.62921      85.1746    -54.0214     81.6724   -18.458      
1 1 1 2  11 3  o 0 43.4105  0.231224  -0.113856    0.354833     0.183298     0.225632     212.781    -40.3291     89.1697   -36.9276     
1 1 1 2  11 4  o 0 15.7907  0.779718  32.5303      5.72949      -9.11868     -3.38621     70.218     15.6976      32.3876   -13.4275     
1 1 1 2  11 5  o 0 43.29    0.221189  3.87124      -0.00621245  -4.16072     -0.647088    147.062    -74.1748     47.7353   81.1955      
1 1 1 2  11 6  o 0 17.6768  0.106727  0.197016     -0.274723    5.87375      2.6702       43.1612    -9.61386     67.6255   -134.194     
1 1 1 2  11 7  o 0 38.833   1.09519   25.9598      -7.99899     -4.62933     3.02568      170.753    -9.38464     46.9349   -28.5992     
1 1 1 2  11 8  o 0 41.6142  1.67604   -65.3841     18.4842      -14.4642     8.38172      177.541    147.691      42.4492   177.022      
1 1 1 2  11 9  o 0 20.3286  1.10801   -11.0762     -50.9458     10.2923      -4.53331     95.8923    -105.253     36.0409   -129.237     
1 1 1 2  11 10 o 0 12.5098  0.258269  17.7959      4.89956      -23.9267     -13.4048     45.815     -24.0965     69.3831   51.1018      
1 1 1 2  11 11 o 0 42.2538  0.529119  -9.41616     -2.25999     -6.43719     -4.38707     201.658    131.647      72.7543   114.278      
1 1 1 2  11 12 o 0 12.3374  0.473162  9.95802      -14.6695     3.10623      8.28253      63.5094    -10.2394     45.0815   -48.2258     
1 1 1 2  11 13 o 0 15.6799  0.606206  13.0891      -17.2653     2.31726      7.50636      77.9862    -12.9507     38.6993   -28.917      
1 1 1 2  11 14 o 0 27.1741  1.38323   -70.0028     9.4959       -19.2342     5.77174      120.955    -160.292     44.4797   161.53       
1 1 1 2  11 15 o 0 16.5308  0.600296  16.3599      14.8376      -0.671416    -8.56205     70.8389    -4.88611     18.8974   -25.9166     
1 1 1 2  11 16 o 0 14.2542  1.08377   -17.0085     -14.2646     -1.01798     -4.87962     53.8887    -128.483     34.3924   154.614      
1 1 1 2  11 17 o 0 19.8205  0.196834  -5.97164     -1.55555     -4.48209     -1.65734     81.9383    -99.4923     50.922    -179.009     
1 1 1 2  11 18 o 0 9.12684  0.843021  3.02317      -3.53788     0.250983     0.926353     38.393     -78.4564     28.5591   -12.7055     
1 1 1 2  12 0  o 0 79.1397  0.472906  0.165359     0            0            0            314.973    0            21.887    1.51227e-13  
1 1 1 2  12 1  o 0 20.6224  0.809783  14.0225      14.9307      0.287296     -5.77281     113.106    35.1606      78.0997   44.7051      
1 1 1 2  12 2  o 0 20.1642  0.307531  -1.19133     -1.52137     0.232627     -1.0379      54.3237    -120.725     37.8705   51.1308      
1 1 1 2  12 3  o 0 39.7274  1.07425   -0.593497    26.8297      10.1781      0.137558     123.323    46.93        71.7314   -100.638     
1 1 1 2  12 4  o 0 21.6623  0.362705  10.2244      -2.15493     -2.93202     1.18846      46.5377    -16.7292     129.417   78.7636      
1 1 1 2  12 5  o 0 24.311   0.764504  7.94573      -19.0915     2.77869      2.86395      91.0111    -69.7138     11.0464   29.6194      
1 1 1 2  12 6  o 0 37.3376  0.653     -2.31009     -9.3699      1.34201      -0.632987    181.673    -117.269     80.7498   -109.507     
1 1 1 2  12 7  o 0 14.2191  1.20597   -37.5874     -80.898      14.2035      -17.0225     56.1573    -121.668     24.1037   157.377      
1 1 1 2  12 8  o 0 7.00206  0.711551  39.4279      11.2973      -11.2534     -6.95251     29.8481    32.8461      25.0702   80.0353      
1 1 1 2  12 9  o 0 42.8342  0.787842  2.72347      23.884       17.3131      -2.46573     117.181    18.5686      109.511   -173.252     
1 1 1 2  12 10 o 0 27.6405  0.971464  -16.9906     8.89272      -2.97675     4.03958      137.192    132.533      59.4313   135.102      
1 1 1 2  12 11 o 0 31.7292  0.721083  11.7554      -9.25591     -0.573446    3.25629      158.959    -67.4322     73.5783   -55.4301     
1 1 1 2  12 12 o 0 7.563    0.157754  0.54163      2.68065      1.73659      -0.656494    16.6779    68.3568      2.06997   4.32246      
1 1 1 2  12 13 o 0 17.6581  1.44312   -13.7381     -75.5734     16.9432      -6.15869     74.2272    -102.278     41.3646   -163.971     
1 1 1 2  12 14 o 0 42.0431  0.42249   8.67624      -2.99742     -4.21931     2.24908      193.698    -92.6391     70.2925   -75.121      
1 1 1 2  12 15 f 1 18.924   0.945772  4.47168      -28.1468     10.4449      3.98574      98.3164    -128.267     40.9836   -114.547     
1 1 1 2  12 16 o 0 20.4346  0.355607  4.97538      -4.83826     -0.630455    3.80693      85.9594    -105.362     13.1853   -37.8733     
1 1 1 2  12 17 o 0 15.3978  0.431656  -0.901579    -0.103525    -0.219091    -0.00148159  67.8766    -163.881     14.052    -162.196     
1 1 1 2  13 0  o 0 5.11859  0.0958705 -0.00889075  1.0888e-18   0            0            0.46976    0            2.63269   -180         
1 1 1 2  13 1  o 0 8.52817  0.463613  1.13953      6.5174       1.11864      -0.420886    52.011     91.6136      55.6457   115.764      
1 1 1 2  13 2  o 0 16.9391  0.107686  -4.48629     1.77257      -11.3824     8.55752      99.2957    -118.553     65.6136   -130.14      
1 1 1 2  13 3  o 0 42.6932  0.942058  -3.19274     8.5719       1.93114      1.43895      187.53     143.591      30.4748   126.531      
1 1 1 2  13 4  o 0 25.5852  0.946878  39.2243      1.42133      -12.6244     -0.688542    61.8188    32.2644      86.5301   -126.542     
1 1 1 2  13 5  o 0 52.1249  0.313393  0.255835     -1.3968      0.422313     0.297432     207.669    -151.447     11.5502   -33.8463     
1 1 1 2  13 6  o 0 15.0943  0.304341  -2.72593     5.09128      1.48619      1.99282      39.1083    81.3683      48.0094   -147.474     
1 1 1 2  13 7  o 0 31.3649  0.222087  0.13806      0.373243     1.58995      0.122013     136.026    10.6547      23.2807   -1.36254     
1 1 1 2  13 8  o 0 46.942   0.293016  -7.82966     -1.15663     -11.722      0.163438     229.942    -99.1936     85.8067   -102.692     
1 1 1 2  13 9  f 1 14.9063  1.19837   0.685568     -53.8369     12.0463      0.17972      67.6285    -86.4377     27.8629   -47.9308     
1 1 1 2  13 10 o 0 47.0777  0.297738  -7.35164     -1.43235     -7.14949     -0.877982    204.483    -105.248     41.9641   -86.9716     
1 1 1 2  13 11 f 1 27.5776  0.422693  1.16877      -6.52348     1.36225      0.399003     101.819    -111.575     14.6398   11.0776      
1 1 1 2  13 12 o 0 36.0923  0.225705  1.10315      0.335741     -2.52887     0.416361     163.36     101.445      52.6908   82.719       
1 1 1 2  13 13 o 0 10.0149  0.502277  4.48531      18.331       6.62551      -3.594       30.0411    27.873       14.3328   -124.454     
1 1 1 2  13 14 o 0 22.2609  0.223532  6.87526      0.965171     -12.4219     -0.312796    89.6158    80.6803      13.6263   -36.5648     
1 1 1 2  13 15 o 0 9.28114  0.879489  5.20468      17.6651      4.20036      -2.84051     43.031     83.5842      24.007    36.6911      
1 1 1 2  13 16 o 0 12.4712  0.459329  -2.3157      -0.59102     -0.694211    -0.783833    31.6376    161.106      36.8006   -0.41901     
1 1 1 2  13 17 o 0 29.3241  0.637339  -0.250627    0.0711935    0            0            109.358    -176.615     17.6324   4.69013      
1 1 1 2  14 0  o 0 7.82304  0.100951  0.0172044    0            0            0            2.47672    -180         3.73127   6.02968e-13  
1 1 1 2  14 1  o 0 26.3797  0.252746  -0.197896    -1.08111     2.2339       -2.02538     114.773    -18.9678     31.4221   -75.358      
1 1 1 2  14 2  o 0 33.2108  0.30759   0.914237     0.0531695    -2.14754     1.1857       136.279    -76.2845     26.7396   -155.728     
1 1 1 2  14 3  o 0 25.4372  0.30365   -0.801661    17.2998      9.00973      1.27964      124.528    37.7659      67.3019   -3.83071     
1 1 1 2  14 4  o 0 20.2512  0.927285  15.4342      11.0887      -1.50301     -4.15785     36.789     42.7032      100.946   -92.8747     
1 1 1 2  14 5  o 0 4.39968  0.520154  -2.88525     -9.46713     2.00757      -1.37217     13.9706    -1.93115     49.5098   33.385       
1 1 1 2  14 6  o 0 45.6141  0.279682  -0.547571    0.95685      1.20081      0.303123     190.338    144.192      19.8127   175.892      
1 1 1 2  14 7  o 0 13.8821  0.888277  0.0859669    32.3995      8.94933      -0.15964     69.7127    103.148      38.5673   80.9582      
1 1 1 2  14 8  o 0 8.13298  0.89733   35.121       -1.65197     -9.554       0.835939     34.2464    -9.10333     16.1761   -56.2254     
1 1 1 2  14 9  o 0 11.3651  1.13663   5.39302      86.0764      26.7813      -3.5734      66.1869    76.2587      56.8825   89.9764      
1 1 1 2  14 10 o 0 25.1153  0.53175   11.048       3.97444      -5.32331     -5.1384      103.616    82.7739      28.9972   141.402      
1 1 1 2  14 11 o 0 18.2298  0.147886  -0.0780987   -0.343789    0.707053     0.0746751    82.2654    -157.857     29.0304   -166.292     
1 1 1 2  14 12 o 0 28.9861  0.326472  -0.48219     1.68481      0.733869     1.20453      133.51     -168.038     24.3372   -171.101     
1 1 1 2  14 13 o 0 26.861   0.198912  1.42295      -1.84993     6.72936      3.84711      103.159    10.8895      19.1287   -144.996     
1 1 1 2  14 14 o 0 4.8453   0.207866  -3.83433     1.45214      -4.07836     3.19022      32.4364    128.233      50.059    154.993      
1 1 1 2  14 15 o 0 14.5654  1.26114   -1.34232     11.0806      2.45462      0.937565     55.7339    86.0183      5.04425   -66.6927     
1 1 1 2  14 16 o 0 29.5913  0.642932  1.87492      1.40528      -0.31371     -0.28292     122.606    101.895      10.6845   52.5941      
1 1 1 2  15 0  o 0 23.3709  0.197293  0.108411     0            0            0            95.7828    180          16.0616   -1.10716e-14 
1 1 1 2  15 1  o 0 23.3284  0.371154  9.94939      3.35969      -2.53727     -2.11335     79.5288    14.6224      26.4003   -156.06      
1 1 1 2  15 2  o 0 55.4398  1.08419   -4.08698     -0.162133    -1.02306     0.178854     204.019    144.862      41.0472   -40.1333     
1 1 1 2  15 3  o 0 20.7338  0.204616  -2.03759     6.42593      2.76211      2.2903       71.876     165.353      26.5269   -58.7998     
1 1 1 2  15 4  o 0 23.4786  0.641136  15.029       -5.16114     -3.16309     2.27369      89.7916    -18.396      5.73869   -161.15      
1 1 1 2  15 5  o 0 24.0724  0.670263  -17.0821     7.95212      -3.76872     4.16788      103.739    142.349      21.6301   127.943      
1 1 1 2  15 6  o 0 35.1002  0.258486  0.344754     0.47687      0.0377274    -0.343193    144.866    -7.19416     14.0011   -10.1087     
1 1 1 2  15 7  o 0 25.2449  0.68254   -11.6216     -13.5428     1.05962      -5.09557     100.233    -91.1271     37.5531   -169.927     
1 1 1 2  15 8  o 0 3.58781  0.477145  -15.3988     -2.7778      -8.64268     -3.31852     10.1234    157.553      26.3979   110.649      
1 1 1 2  15 9  o 0 40.0271  1.22573   5.38187      -19.2486     3.74793      2.59299      150.638    -50.3285     12.0809   175.629      
1 1 1 2  15 10 o 0 9.67815  0.666359  -11.1273     4.03499      -3.16418     2.46719      46.4937    136.764      19.9394   146.967      
1 1 1 2  15 11 o 0 19.7627  0.993333  15.086       -3.81299     -3.66665     1.71143      64.4096    -22.9716     34.9122   163.887      
1 1 1 2  15 12 o 0 33.8847  0.878178  -9.26104     -9.75129     -0.131327    -2.484       146.888    -129.945     11.6449   -124.792     
1 1 1 2  15 13 o 0 18.6781  0.816596  3.62248      3.14372      0.176201     -1.59171     73.7041    39.0726      6.53177   -87.3777     
1 1 1 2  15 14 f 1 20.0887  0.593646  6.29555      0.268635     -2.54039     -1.03343     105.903    67.4054      50.6905   60.788       
1 1 1 2  16 0  o 0 7.56307  0.168109  -0.0629497   7.70911e-18  0            0            28.2671    0            26.6898   180          
1 1 1 2  16 1  o 0 42.3443  0.457121  -0.100905    -0.267791    -0.288186    0.560139     189.014    78.8836      38.7318   72.8337      
1 1 1 2  16 2  o 0 30.3824  0.244942  -0.460247    -0.289415    -1.2657      2.29671      129.559    -115.28      18.8638   -142.067     
1 1 1 2  16 3  o 0 20.8679  0.241956  -1.02401     -5.34699     1.4811       -0.491942    87.1125    -128.26      11.071    -126.097     
1 1 1 2  16 4  o 0 13.359   0.525123  8.72303      18.1702      4.46509      -5.37612     45.532     93.0329      39.733    -5.27713     
1 1 1 2  16 5  o 0 30.7411  0.458125  -7.04452     -2.36064     -1.54378     -1.47329     117.523    -157.079     6.31772   44.2972      
1 1 1 2  16 6  o 0 21.3566  0.217417  0.262959     1.84389      7.22776      1.2099       85.657     178.875      27.9617   103.473      
1 1 1 2  16 7  o 0 25.6607  0.254539  0.519096     -0.045343    0.208308     1.4782       113.494    -130.027     9.0978    -154.683     
1 1 1 2  16 8  o 0 35.4083  0.796152  -5.40442     1.53724      -1.37002     0.5191       203.076    -155.437     106.076   -157.581     
1 1 1 2  16 9  o 0 16.0364  0.395294  1.41516      4.23625      3.0921       -1.60286     62.9004    5.85426      20.8543   -101.12      
1 1 1 2  16 10 o 0 6.93237  1.05493   -11.7516     -17.1227     2.02401      -4.97182     21.6826    -119.941     20.9713   -8.38091     
1 1 1 2  16 11 o 0 30.5179  0.345413  -1.52405     -0.723709    -0.558602    -0.0957437   150.221    -163.979     47.9617   -161.034     
1 1 1 2  16 12 o 0 11.7972  1.03049   2.7623       -7.53029     1.53764      1.7257       33.6544    -76.0491     26.8469   122.392      
1 1 1 2  16 13 o 0 12.1962  0.183606  -0.252921    -0.580735    0.645206     1.81905      49.3139    -143.508     8.53858   -67.5777     
1 1 1 2  17 0  o 0 5.22494  0.184741  -0.0436829   5.34961e-18  0            0            8.9588     -180         4.33479   2.53212e-13  
1 1 1 2  17 1  o 0 12.2066  0.18558   0.119781     0.247738     0            0            45.9756    -30.1113     9.2887    119.827      
1 1 1 2  17 2  o 0 28.4233  0.376036  -0.159435    0.427693     0.194356     0.00522855   135.508    149.244      23.7564   149.925      
1 1 1 2  17 3  o 0 23.5079  0.368475  -1.25922     1.13049      0.205656     0.830501     105.763    67.5998      9.20119   78.6617      
1 1 1 2  17 4  o 0 16.7369  0.334693  1.2489       -2.69972     1.28764      1.07783      83.8006    -5.64644     26.4265   -12.0116     
1 1 1 2  17 5  f 1 17.3512  1.21548   -24.743      3.86937      -6.00971     2.19826      100.196    147.443      61.2848   171.119      
1 1 1 2  17 6  o 0 16.1115  0.518951  0.323834     6.63606      2.78381      -0.0215038   66.3236    122.98       7.70616   -147.629     
1 1 1 2  17 7  f 1 14.5877  1.06731   -14.8694     -10.0864     -1.48337     -3.33109     54.7299    -141.209     12.1486   46.433       
1 1 1 2  17 8  o 0 16.384   0.686387  -2.48669     -1.16779     -0.289334    -0.220109    79.4439    -157.962     24.6215   -154.079     
1 1 1 2  17 9  o 0 25.5026  0.258682  1.56225      -0.4853      -0.194267    0.682784     125.649    -17.1025     40.2191   -11.833      
1 1 1 2  17 10 o 0 7.89797  0.658723  -1.69963     3.4569       0.679839     0.698602     35.8463    136.28       15.5419   109.098      
1 1 1 3  0  1  o 0 51.6769  0.311602  1.39959e-16  0.45714      0            0            223.643    -90          1.97303   -90          
1 1 1 3  0  2  o 0 8.84873  0.0839576 0.126698     0            0            0            7.10013    0            0.612376  1.03665e-12  
1 1 1 3  0  3  o 0 19.8318  0.137707  6.96843e-17  0.227606     0            0            85.1075    90           0.922222  -90          
1 1 1 3  0  4  o 0 77.6498  0.453876  0.404198     0            0            0            351.081    180          63.4409   -180         
1 1 1 3  0  5  o 0 60.8712  0.422545  3.12737e-17  0.102148     0            0            276.017    90           17.7673   90           
1 1 1 3  0  6  o 0 17.8718  0.152566  -0.00398583  4.88124e-19  0            0            76.9439    0            31.7571   -180         
1 1 1 3  0  7  o 0 31.6338  0.244672  -2.69001e-17 -0.146437    0            0            137.322    -90          12.1699   -90          
1 1 1 3  0  8  o 0 34.176   0.307382  -0.130991    1.60418e-17  0            0            147.347    180          34.8108   -180         
1 1 1 3  0  9  o 0 107.63   0.874128  -6.93264e-17 -0.377395    0            0            460.943    -90          84.3114   -90          
1 1 1 3  0  10 o 0 40.0412  0.357669  -0.17907     2.19298e-17  0            0            162.015    -180         19.7413   4.50611e-15  
1 1 1 3  0  11 o 0 31.5896  0.268369  7.94825e-18  0.025961     0            0            126.76     -90          16.1623   90           
1 1 1 3  0  12 o 0 30.8334  0.241346  0.0869585    0            0            0            80.9451    0            59.9941   -5.03813e-15 
1 1 1 3  0  13 o 0 5.79655  0.151266  6.77296e-18  0.0221222    0            0            7.91123    -90          52.0572   90           
1 1 1 3  0  14 f 1 13.7695  0.1295    0.0821902    0            0            0            52.3904    180          21.8053   -3.00036e-14 
1 1 1 3  0  15 o 0 10.4211  0.132643  6.57924e-18  0.0214894    0            0            26.1309    -90          10.5482   90           
1 1 1 3  0  16 o 0 26.205   0.189429  0.109465     0            0            0            101.561    0            42.3649   180          
1 1 1 3  0  17 o 0 10.4642  0.127449  -5.52754e-18 -0.0300905   0            0            24.4458    -90          5.98284   90           
1 1 1 3  0  18 o 0 14.7377  0.147788  -0.0224822   2.75327e-18  0            0            52.8145    0            27.9106   0            
1 1 1 3  0  19 o 0 28.9724  0.20733   -5.7011e-17  -0.310353    0            0            114.393    -90          1.50996   90           
1 1 1 3  0  20 o 0 9.59166  0.128586  -0.171756    2.1034e-17   0            0            36.9784    180          4.40907   -0           
1 1 1 3  0  21 o 0 12.3612  0.136022  -3.0955e-17  -0.168511    0            0            52.7321    -90          2.86928   90           
1 1 1 3  0  22 o 0 23.4862  0.221438  -0.238923    2.92596e-17  0            0            99.0775    180          27.3043   -180         
1 1 1 3  1  0  o 0 8.21584  0.0783644 -3.64897e-18 -0.0198641   0            0            15.4837    90           43.808    -90          
1 1 1 3  1  1  f 1 87.6551  1.13375   25.0263      14.6069      -3.38685     -6.79649     307.116    -12.5128     162.026   124.415      
1 1 1 3  1  2  o 0 64.4217  0.47771   -1.129       -11.4434     27.5424      -12.2414     322.895    172.264      89.2524   159.417      
1 1 1 3  1  3  o 0 20.7597  0.766218  -100.691     3.34937      -94.4034     7.22415      63.5842    142.126      116.695   -120.31      
1 1 1 3  1  4  o 0 27.2136  0.602419  -14.2775     57.7903      40.5795      22.2595      96.0755    149.371      111.931   46.9464      
1 1 1 3  1  5  o 0 40.4013  0.744327  -16.9181     15.3801      -0.59404     12.3053      240.555    74.8801      123.049   70.783       
1 1 1 3  1  6  o 0 24.6224  0.16793   7.22868      5.22936      -5.68122     -14.0807     138.549    -29.913      101.953   16.0063      
1 1 1 3  1  7  o 0 49.7871  1.49213   47.4221      14.1165      -13.4261     -8.10134     204.586    36.3511      50.6663   131.666      
1 1 1 3  1  8  o 0 74.7839  1.14601   -2.53509     -15.7721     5.3259       -1.34655     351.149    -137.814     67.2565   -144.801     
1 1 1 3  1  9  o 0 54.3352  0.285174  -4.62345     1.67186      -6.15666     3.95182      210.37     85.7089      97.3261   -167.011     
1 1 1 3  1  10 o 0 60.8867  0.302564  -0.217177    0.0198956    -0.339093    0.903377     284.753    -127.398     87.1439   -127.521     
1 1 1 3  1  11 o 0 24.9287  0.192981  1.44855      -2.85765     2.64224      3.31669      135.619    19.0284      99.5886   44.8818      
1 1 1 3  1  12 o 0 19.7381  0.981081  31.938       38.4166      2.23486      -11.8273     119.529    56.0487      105.656   79.9474      
1 1 1 3  1  13 o 0 73.8169  0.359669  3.40107      0.139814     -2.89316     -0.607533    310.773    -62.7665     42.1411   -78.6546     
1 1 1 3  1  14 o 0 55.9399  0.479616  -1.59769     -10.387      5.04767      -2.16412     237.899    -36.5033     41.2671   -56.0764     
1 1 1 3  1  15 f 1 82.0736  1.71874   -30.0039     8.09091      -5.75541     4.02096      326.513    149.801      20.5131   -170.657     
1 1 1 3  1  16 o 0 30.5626  0.286039  -7.02603     3.3427       -2.4132      2.52537      130.094    -148.67      31.84     -168.813     
1 1 1 3  1  17 o 0 8.46182  0.441942  3.35047      -12.5589     3.06437      1.79747      29.5433    -42.7077     49.4271   23.8122      
1 1 1 3  1  18 o 0 31.0698  0.20212   3.53365      8.34997      7.24149      -10.0322     108.282    139.11       41.5169   8.44276      
1 1 1 3  1  19 o 0 37.2132  1.46124   65.4904      -2.28398     -14.0113     1.3565       159.462    -9.33372     34.0726   20.7845      
1 1 1 3  1  20 o 0 28.3717  1.24576   -1.66683     60.9506      16.744       0.568366     108.685    115.404      1.75624   -11.4838     
1 1 1 3  1  21 f 1 40.4311  1.57683   -36.8102     12.6141      -5.82254     4.05906      181.435    145.077      25.7361   178.989      
1 1 1 3  1  22 o 0 15.543   1.01527   8.49192      -5.60601     -0.465522    1.01261      70.2674    -11.9445     34.106    -72.7102     
1 1 1 3  1  23 o 0 20.9574  1.88116   0.696778     3.1307       0.107878     -0.0363871   78.4873    110.319      17.9886   -29.8531     
1 1 1 3  2  0  o 0 88.6848  0.588628  -1.48662e-16 -0.809279    0            0            366.233    -90          51.4923   -90          
1 1 1 3  2  1  o 0 21.744   0.810447  52.792       -66.3689     10.8641      49.3755      68.8008    35.9434      76.9839   149.591      
1 1 1 3  2  2  o 0 70.1835  2.23283   18.2229      -63.1759     12.8363      8.90493      290.676    -96.4398     97.6403   0.235079     
1 1 1 3  2  3  o 0 39.5618  1.87851   125.793      16.9862      -32.9159     -9.44767     191.631    18.4788      65.2188   -23.86       
1 1 1 3  2  4  o 0 12.6367  0.633412  -44.283      -55.2354     10.3628      -45.5495     28.4348    -90.6879     8.95676   153.884      
1 1 1 3  2  5  o 0 22.426   1.1434    29.5528      79.7866      20.2896      -17.2653     85.2492    58.5156      11.127    -40.4458     
1 1 1 3  2  6  o 0 67.4289  1.32913   32.5611      -7.6008      -7.28338     3.93321      318.771    -14.0946     47.2052   -3.24293     
1 1 1 3  2  7  o 0 49.7846  1.1655    -12.9388     18.5327      2.74774      8.23592      235.572    167.41       63.1961   -161.56      
1 1 1 3  2  8  o 0 50.002   0.557389  1.31743      -11.2913     6.55029      1.22226      230.507    -20.6511     39.8857   -23.1521     
1 1 1 3  2  9  o 0 36.9594  0.259417  3.56579      0.817442     -3.04969     -1.17609     159.279    -62.6808     84.6908   1.55675      
1 1 1 3  2  10 o 0 61.4323  1.42136   23.3681      16.6015      -2.02534     -6.47961     274.91     36.8403      65.6712   30.6954      
1 1 1 3  2  11 o 0 51.6214  0.242438  -0.779823    2.75899      12.4629      2.62929      220.483    178.276      72.862    119.473      
1 1 1 3  2  12 o 0 63.7483  0.727802  10.9017      -7.02642     -1.80647     3.44693      286.568    -29.0953     79.1744   -31.697      
1 1 1 3  2  13 o 0 69.341   0.911647  -10.0495     9.62152      0.0333752    4.82017      311.088    160.175      83.3838   172.275      
1 1 1 3  2  14 o 0 35.8602  0.319276  4.1909       9.33051      5.10917      -6.57165     153.758    134.121      41.9252   90.9892      
1 1 1 3  2  15 o 0 23.3891  0.434421  -7.20336     -6.25582     -0.752511    -4.43424     73.1206    168.722      48.2004   51.7613      
1 1 1 3  2  16 o 0 11.6267  0.369411  16.6318      10.6629      -7.3875      -15.4865     57.1355    76.4218      56.9141   24.1289      
1 1 1 3  2  17 o 0 45.4148  0.55722   -3.68558     19.867       6.89764      3.0125       183.454    49.7554      49.2652   128.263      
1 1 1 3  2  18 o 0 26.184   0.281368  -6.02935     5.98905      -0.181159    3.46951      118.136    -171.059     33.4948   178.111      
1 1 1 3  2  19 o 0 29.8407  0.291     11.489       -6.48677     -6.24224     13.0877      125.052    41.303       34.9815   -14.5756     
1 1 1 3  2  20 o 0 28.5262  0.144241  -1.58184     -7.41811     14.9883      -10.6621     113.69     -24.4831     10.4494   -67.2941     
1 1 1 3  2  21 o 0 18.7831  0.490711  -9.50541     -4.65106     -3.3506      -5.32959     92.0645    -87.9151     28.2809   -99.1404     
1 1 1 3  2  22 o 0 10.0471  0.453272  -7.34606     -5.49846     -1.69086     -4.75114     45.3824    -80.594      15.9372   -31.9918     
1 1 1 3  2  23 o 0 12.2383  0.526813  -1.81304     3.92904      1.46953      1.02108      38.0387    144.663      24.1371   -71.6078     
1 1 1 3  3  0  o 0 64.5864  0.525235  1.23287e-16  0.402687     0            0            268.869    90           15.6983   -90          
1 1 1 3  3  1  o 0 58.0374  0.840843  -12.5384     -27.88       11.0082      -11.0143     214.088    -171.445     65.4844   -18.0169     
1 1 1 3  3  2  o 0 23.1453  1.00227   -58.1521     -60.3298     1.67172      -36.1121     105.513    164.805      32.3884   105.527      
1 1 1 3  3  3  o 0 25.5379  0.773626  37.1785      -4.55226     -16.4777     4.36057      93.9358    -58.4049     36.5069   91.4594      
1 1 1 3  3  4  o 0 37.5056  0.200048  2.47752      -2.60434     -3.61085     16.6319      167.88     53.3341      38.6518   127.397      
1 1 1 3  3  5  o 0 17.0875  1.69479   -27.2503     195.273      55.5535      16.0092      29.0273    77.3594      79.3927   -76.8894     
1 1 1 3  3  6  o 0 18.8108  2.07426   -283.616     -13.9758     -73.392      -7.02447     74.5135    -164.254     38.903    -73.5053     
1 1 1 3  3  7  f 1 42.492   0.617228  -9.95797     -16.0344     3.13522      -6.81735     211.252    -74.0584     68.6202   -66.7969     
1 1 1 3  3  8  f 1 40.4597  0.801847  -7.41844     -7.15194     -0.0717318   -1.62092     121.842    -131.231     92.8588   60.8918      
1 1 1 3  3  9  o 0 60.7979  0.665377  -4.99584     8.69875      1.81092      2.70874      247.238    139.513      19.2597   179.888      
1 1 1 3  3  10 o 0 82.5471  1.33269   -15.0571     1.862        -3.51407     0.701104     368.15     144.661      84.762    153.409      
1 1 1 3  3  11 o 0 25.0437  1.36986   -3.44104     -86.7127     20.3753      -1.5562      110.449    -87.7998     47.3224   -40.0475     
1 1 1 3  3  12 o 0 49.9873  0.997421  38.3616      2.04506      -14.7514     -1.34005     192.455    48.5725      45.0829   -49.4014     
1 1 1 3  3  13 o 0 22.6273  0.522634  -7.00416     -7.1629      0.0908906    -2.1749      62.233     -134.678     51.4875   85.5059      
1 1 1 3  3  14 o 0 26.7114  0.142465  0.45684      0.558687     -0.829347    -2.28297     103.704    123.879      44.3821   45.6597      
1 1 1 3  3  15 f 1 9.92773  0.901742  18.5583      -38.6565     8.41648      10.4152      94.3223    -65.5329     132.838   -79.4858     
1 1 1 3  3  16 f 1 46.5062  0.223167  6.82805      -2.63242     -11.1313     5.46896      221.983    -94.6402     72.1372   -92.9532     
1 1 1 3  3  17 o 0 16.7759  1.23284   1.68127      -73.4591     18.9371      0.710804     75.9079    -87.1052     24.0517   -78.7986     
1 1 1 3  3  18 o 0 26.0643  1.07551   48.8445      13.0926      -13.0431     -7.92127     107.673    -17.1079     15.7759   19.0289      
1 1 1 3  3  19 o 0 30.5237  0.847867  -17.8459     -1.0214      -3.90935     -0.280691    125.218    -154.411     20.3925   169.038      
1 1 1 3  3  20 o 0 16.583   0.810039  4.14347      -38          10.0144      2.05486      78.0226    -94.7275     34.4293   -83.1386     
1 1 1 3  3  21 o 0 19.5899  0.907005  -14.0291     18.6203      2.0862       6.25332      96.4187    155.076      32.423    144.501      
1 1 1 3  3  22 o 0 22.822   0.893963  -12.6635     6.18774      -3.61837     4.05328      107.717    -145.45      40.7674   171.47       
1 1 1 3  3  23 o 0 6.02329  0.651485  -0.659064    -3.71862     1.18815      -0.315529    31.0379    -101.768     27.0788   -105.082     
1 1 1 3  4  0  f 1 32.1792  0.234463  1.18075e-16  0.385663     0            0            135.661    90           27.8726   -90          
1 1 1 3  4  1  o 0 59.2605  0.525727  -4.30583     41.2552      24.2436      6.682        251.882    39.4593      99.8512   123.222      
1 1 1 3  4  2  o 0 49.1201  0.297223  5.87906      -2.44424     -5.04987     6.34878      227.684    50.1595      78.3165   -7.43496     
1 1 1 3  4  3  o 0 6.80088  0.772133  29.9337      22.5154      -2.19404     -7.51359     43.9191    -50.2665     105.068   -82.6242     
1 1 1 3  4  4  o 0 47.1896  0.874009  29.2029      4.50887      -12.091      -4.34306     221.335    -44.315      34.8359   -43.1013     
1 1 1 3  4  5  o 0 78.59    1.20614   -4.40563     -28.2448     11.1931      -2.77841     366.138    -44.5935     77.812    -67.1469     
1 1 1 3  4  6  o 0 84.1495  2.02189   23.4178      -4.08904     -6.51507     1.96863      379.333    15.6918      52.2164   10.9933      
1 1 1 3  4  7  o 0 48.1893  1.76262   5.34916      51.4671      10.6391      -2.39757     209.047    90.008       38.8554   29.0199      
1 1 1 3  4  8  o 0 22.8114  0.267426  -2.54587     -0.394019    -0.683307    -0.180423    58.047     168.545      53.5534   -30.4119     
1 1 1 3  4  9  o 0 93.6914  0.411416  -0.301318    0.428388     0.0221109    0.376201     346.864    94.7901      49.3186   -79.6282     
1 1 1 3  4  10 o 0 54.4779  1.42169   48.08        -14.3033     -9.31234     6.29796      232.686    -10.171      41.8899   -25.1739     
1 1 1 3  4  11 o 0 70.9519  1.09169   2.87313      30.2829      16.8527      -2.23478     270.152    23.0091      17.7414   173.939      
1 1 1 3  4  12 o 0 37.0906  0.775805  34.8858      0.073605     -12.1572     0.112866     182.549    -39.4604     79.6243   -29.6551     
1 1 1 3  4  13 o 0 21.185   0.909504  14.5638      35.7413      7.48816      -7.20907     85.081     59.8125      69.5119   131.077      
1 1 1 3  4  14 o 0 27.7441  0.279787  -2.59107     1.0666       -1.1028      1.33552      124.862    -142.147     42.067    -139.977     
1 1 1 3  4  15 o 0 24.9285  0.20776   0.449835     6.13702      5.75926      -1.38638     100.817    152.811      33.8596   89.9237      
1 1 1 3  4  16 o 0 37.2602  1.18359   -54.9123     1.26303      -14.8082     0.987738     136.121    -177.129     21.1065   -21.544      
1 1 1 3  4  17 o 0 3.81224  0.633793  4.99605      26.4647      12.7105      -5.04254     25.9585    13.442       69.5757   -5.55542     
1 1 1 3  4  18 o 0 29.8606  0.319382  -8.00071     0.693128     -6.58424     1.886        121.759    99.5014      13.3629   126.375      
1 1 1 3  4  19 o 0 22.3505  0.845912  -10.3459     28.6751      6.90435      5.37015      79.1875    136.93       12.8511   -14.2717     
1 1 1 3  4  20 o 0 29.9351  0.298171  4.24856      2.82759      -0.815481    -1.60489     102.701    69.5107      21.4706   -117.312     
1 1 1 3  4  21 o 0 21.4986  0.968686  -12.0621     -15.7413     1.09918      -5.21032     107.989    -155.085     42.274    -138.706     
1 1 1 3  4  22 o 0 22.886   1.67958   -14.6463     0.227147     -2.73324     -0.385416    108.426    -179.412     31.3473   170.633      
1 1 1 3  4  23 o 0 4.61888  0.357472  0.619108     3.2145       2.97122      -0.644259    4.07908    -142.118     23.1685   -74.2942     
1 1 1 3  5  0  o 0 69.6233  0.400571  -9.57987e-17 -0.521504    0            0            295.744    -90          30.6683   90           
1 1 1 3  5  1  o 0 24.0727  1.84191   3.95364      192.5        48.3548      -1.80572     88.7257    80.2443      42.3764   -36.2766     
1 1 1 3  5  2  o 0 33.7619  0.371822  -14.1182     0.72682      -14.6495     2.38254      142.113    -98.9923     58.5968   -10.7182     
1 1 1 3  5  3  o 0 17.3288  0.405205  13.1012      1.13201      -3.19733     -0.517331    75.5874    8.18531      40.6397   61.9184      
1 1 1 3  5  4  o 0 28.2184  1.13436   31.9415      6.4875       -8.31274     -3.4192      70.8383    4.94068      105.549   140.878      
1 1 1 3  5  5  o 0 26.7751  1.77617   -18.3081     -61.1365     14.902       -9.63126     84.002     -106.743     47.311    95.2322      
1 1 1 3  5  6  o 0 42.3772  1.91558   71.6487      -11.295      -18.3969     6.23921      236.515    -24.7047     133.627   -7.27063     
1 1 1 3  5  7  f 1 56.4781  1.35589   6.6272       -16.9926     3.96102      3.95596      253.605    -93.4499     65.412    -102.821     
1 1 1 3  5  8  o 0 57.1673  0.835574  5.28598      -12.7586     2.30577      2.15441      204.988    -69.0585     38.6379   103.845      
1 1 1 3  5  9  o 0 50.0111  0.831698  -19.7853     -10.5043     -3.4197      -4.8535      222.298    -131.695     57.5385   -139.143     
1 1 1 3  5  10 o 0 18.9248  0.544199  31.2785      9.38868      -16.9336     -11.3254     70.709     62.3312      53.4178   -23.6138     
1 1 1 3  5  11 o 0 26.9079  0.142181  0.201625     0.153752     13.0826      -10.1156     117.178    -29.9102     53.8802   -88.5663     
1 1 1 3  5  12 o 0 35.2839  0.991532  -36.7515     15.4628      -10.2394     10.8519      185.256    -156.261     106.27    -141.776     
1 1 1 3  5  13 f 1 12.7594  0.883703  -19.6182     22.0092      0.701713     6.35719      80.3219    139.497      76.7511   161.138      
1 1 1 3  5  14 o 0 71.4423  0.428803  -2.0996      4.72505      1.8109       1.34855      337.403    153.236      127.869   156.148      
1 1 1 3  5  15 o 0 20.478   1.00393   39.8412      37.1937      -1.26389     -15.5068     88.1698    52.1813      73.2135   -13.9119     
1 1 1 3  5  16 o 0 58.671   0.468272  8.3944       0.501967     -9.6132      1.62334      248.004    68.133       67.0693   126.102      
1 1 1 3  5  17 o 0 33.8608  0.161791  -0.908806    -6.00346     14.8604      -0.643686    126.065    -177.651     28.4587   67.8727      
1 1 1 3  5  18 o 0 33.7647  0.163353  1.85531      0.0837435    -10.578      8.91316      126.135    68.7069      11.4681   -148.63      
1 1 1 3  5  19 o 0 26.9117  0.40724   4.31169      -6.01914     0.687957     2.56108      105.823    -17.0818     7.81446   -2.52716     
1 1 1 3  5  20 o 0 15.3633  0.257267  -1.11442     0.957621     0.0239517    0.383075     50.3262    171.266      11.5202   -0.899693    
1 1 1 3  5  21 o 0 38.8293  1.09587   2.44306      14.6372      2.96773      -0.67349     180.92     109.67       43.2634   94.7322      
1 1 1 3  5  22 o 0 15.5649  1.19556   -9.42642     3.04671      -1.81049     1.68211      64.088     -168.046     9.57387   126.399      
1 1 1 3  6  0  o 0 90.5516  0.585915  -8.08622e-17 -0.440193    0            0            373.91     -90          11.7988   -90          
1 1 1 3  6  1  o 0 69.7619  0.886482  -7.23091     -24.9587     8.82361      -4.99125     304.697    -55.2244     39.3836   -80.8828     
1 1 1 3  6  2  o 0 27.1902  0.543753  11.8208      13.7646      1.79052      -10.0961     153.17     -14.08       84.9948   -20.4241     
1 1 1 3  6  3  o 0 68.0611  0.886566  -8.22646     3.15937      -1.65811     1.32724      289.628    118.925      30.949    174.841      
1 1 1 3  6  4  o 0 19.661   1.15674   23.1285      -24.9295     0.655396     8.2529       53.0591    -51.3385     53.1386   153.817      
1 1 1 3  6  5  o 0 40.4444  1.3215    5.68387      -42.9355     10.7551      2.7651       149.774    -67.4359     93.2426   -170.688     
1 1 1 3  6  6  o 0 41.739   1.34935   -26.9525     2.35267      -7.95133     1.25284      125.094    -173.535     72.368    3.65946      
1 1 1 3  6  7  o 0 31.4637  0.51359   6.34466      7.51343      1.88031      -9.08661     121.703    -1.09475     122.559   76.2266      
1 1 1 3  6  8  o 0 35.6156  0.232616  6.17516      16.136       12.2451      -11.5765     119.23     128.051      89.9602   19.6609      
1 1 1 3  6  9  o 0 71.6955  1.31711   23.0422      -7.24124     -5.71997     3.62728      316.081    -31.1607     75.2614   -37.8755     
1 1 1 3  6  10 o 0 57.9343  0.498645  -6.9195      14.7669      8.36933      8.7374       214.821    -178.341     42.366    56.0691      
1 1 1 3  6  11 o 0 28.0966  0.910874  0.501143     41.8073      15.1677      -0.506707    80.8951    40.8401      58.7562   -113.807     
1 1 1 3  6  12 o 0 21.1618  1.20698   40.0177      23.8667      -4.20292     -7.95184     96.2134    29.5336      32.1759   21.041       
1 1 1 3  6  13 o 0 4.53643  0.538064  -24.6095     -10.4153     -10.7296     -11.1496     4.13901    -133.877     11.2105   -21.3941     
1 1 1 3  6  14 o 0 39.8438  0.443996  1.5508       20.9371      12.8048      -1.10483     160.709    21.8785      18.2639   22.716       
1 1 1 3  6  15 o 0 52.1519  0.632496  6.20398      -5.41021     -0.0217711   4.46674      225.225    14.0543      39.8131   29.9532      
1 1 1 3  6  16 o 0 22.2492  0.271949  7.54377      -4.10244     -5.05019     9.20795      113.798    49.391       55.783    63.5354      
1 1 1 3  6  17 o 0 34.7821  0.774746  -7.55709     -22.6142     7.38898      -6.11542     114.157    -57.0031     50.4161   160.26       
1 1 1 3  6  18 f 1 13.3403  0.825186  -46.3977     -13.3305     -12.411      -7.94696     63.5504    -176.448     58.5422   -125.412     
1 1 1 3  6  19 o 0 15.0054  0.595967  15.64        14.2456      -0.464665    -6.25389     78.8683    10.8968      53.2536   35.4815      
1 1 1 3  6  20 o 0 17.1746  0.304447  -0.753918    4.76846      2.87059      0.465981     69.6495    28.943       16.5728   119.274      
1 1 1 3  6  21 o 0 17.3759  0.194534  -0.308541    0.113957     1.96327      -0.0423799   94.8759    4.19768      50.4439   0.278087     
1 1 1 3  6  22 o 0 9.66059  0.591767  4.51974      -1.48345     -2.32266     1.06927      34.889     -58.9116     19.2496   -144.237     
1 1 1 3  7  0  o 0 151.246  0.95725   1.5613e-16   0.509958     0            0            626.499    -90          22.3047   -90          
1 1 1 3  7  1  o 0 72.1302  0.884425  -6.15567     12.8266      3.82437      4.27969      380.421    161.285      169.191   165.081      
1 1 1 3  7  2  o 0 50.3019  0.683483  -7.07623     11.5083      1.89112      4.02069      190.176    166.667      54.9644   43.7406      
1 1 1 3  7  3  o 0 47.4636  1.57189   -42.1721     2.31971      -11.6428     1.50622      203.013    -174.609     23.6019   -150.749     
1 1 1 3  7  4  o 0 56.7012  0.240572  -1.40175     -2.76199     2.3495       -6.02272     208.197    153.246      49.0116   28.3944      
1 1 1 3  7  5  o 0 25.4386  0.739378  12.3597      9.96118      -1.58692     -8.14935     134.044    93.3521      94.3627   96.6286      
1 1 1 3  7  6  o 0 31.5457  0.417497  5.50246      -2.08119     -3.56493     2.86504      106.849    -97.2571     74.5934   157.677      
1 1 1 3  7  7  o 0 44.1119  1.21867   55.8643      -32.1223     -8.69523     15.4087      176.959    -10.0292     16.0252   -48.379      
1 1 1 3  7  8  o 0 83.3362  0.353355  -0.287398    -7.6005      8.25312      0.877887     339.545    -166.121     39.3322   -120.694     
1 1 1 3  7  9  o 0 37.6375  2.01074   -134.405     12.8034      -28.3342     5.33264      170.695    172.419      52.4494   150.209      
1 1 1 3  7  10 o 0 58.1416  0.56393   4.85634      8.75878      3.25201      -5.88161     265.152    31.6075      108.899   1.88248      
1 1 1 3  7  11 o 0 69.1366  0.31121   -1.55166     -0.833579    -0.293756    -1.33287     322.641    -46.3971     110.506   -53.2936     
1 1 1 3  7  12 o 0 46.7086  0.492542  -8.04954     12.5785      1.38527      3.28195      173.691    106.805      10.3474   -92.2054     
1 1 1 3  7  13 o 0 27.7059  1.36858   73.9715      -27.3569     -12.7324     10.7225      124.299    -19.6871     58.4705   22.5593      
1 1 1 3  7  14 f 1 81.1592  1.00687   0.083656     -13.2279     6.55548      -1.49591     367.474    -38.9905     89.1341   -31.4628     
1 1 1 3  7  15 f 1 30.4085  0.257057  21.8046      1.70006      -21.1629     -4.84237     115.848    -67.1617     13.865    58.1956      
1 1 1 3  7  16 o 0 19.5384  0.627591  -13.1619     -8.82524     -2.19738     -4.92061     68.2011    -106.883     20.227    123.487      
1 1 1 3  7  17 o 0 22.2464  0.426637  1.25421      -10.459      6.73256      1.23723      66.2029    -149.689     38.9003   17.7335      
1 1 1 3  7  18 o 0 19.734   0.537737  14.0735      -21.8216     3.89143      9.32791      78.5344    -100.805     38.8642   -28.5154     
1 1 1 3  7  19 o 0 12.1226  0.677662  -15.669      9.88946      -3.46491     6.55602      45.7123    101.554      3.82474   162.456      
1 1 1 3  7  20 o 0 6.82427  0.500982  -1.85369     -5.93875     1.61852      -1.04882     41.0142    -115.401     39.5949   -104.835     
1 1 1 3  7  21 o 0 4.50729  0.411749  1.26367      1.23094      -0.106585    -0.77643     8.75924    56.7484      9.08676   -94.3679     
1 1 1 3  7  22 o 0 5.67217  0.729222  3.54816      -0.12076     -0.843667    0.138723     24.7011    4.01933      13.2139   -13.6569     
1 1 1 3  8  0  o 0 31.1913  0.191186  1.60849e-17  0.0525373    0            0            75.8193    -90          53.3745   -90          
1 1 1 3  8  1  o 0 114.97   0.479844  -0.240204    -0.75853     -0.359211    -1.0276      437.446    -65.6798     30.8654   109.911      
1 1 1 3  8  2  o 0 82.4917  1.71583   8.11506      26.9403      6.2382       -4.66676     279.83     104.565      89.8982   -68.2504     
1 1 1 3  8  3  o 0 62.1468  1.54164   23.0127      -0.278035    -5.26742     -0.0297599   272.859    39.5609      135.782   -18.2532     
1 1 1 3  8  4  o 0 61.436   0.648888  -1.86506     17.8763      7.86803      1.40731      288.797    40.5235      96.7896   43.3709      
1 1 1 3  8  5  o 0 38.465   0.689653  10.2572      -7.10291     -1.57042     3.89344      115.147    -25.0806     61.7625   149.94       
1 1 1 3  8  6  o 0 62.6186  0.708283  4.16107      0.683842     -0.871934    -0.366812    303.718    -65.4735     131.164   -46.7112     
1 1 1 3  8  7  o 0 60.7949  0.650643  -9.36537     0.473236     -4.30517     0.251286     265.662    -124.812     60.441    -131.589     
1 1 1 3  8  8  o 0 63.8795  1.76991   -10.1645     -63.1517     16.6344      -5.8012      290.77     -121.958     84.6248   -111.355     
1 1 1 3  8  9  o 0 87.1454  0.445619  2.78063      0.952583     -8.4387      2.44818      336.27     75.2691      35.8612   178.321      
1 1 1 3  8  10 o 0 17.8188  1.33427   -14.0239     -83.9548     23.9736      -8.41724     75.9154    -91.1024     63.9976   -154.995     
1 1 1 3  8  11 f 1 43.4066  0.39268   -4.69276     -1.69164     -0.823337    -0.790306    150.433    -164.286     30.5902   18.3367      
1 1 1 3  8  12 o 0 32.5225  0.172182  -0.541159    -2.63332     5.41696      -0.305823    156.454    -174.422     96.6713   -134.763     
1 1 1 3  8  13 o 0 47.0882  0.216741  2.27842      -1.23143     -12.5038     3.37071      160.541    -95.1569     54.5814   89.5903      
1 1 1 3  8  14 o 0 16.816   0.675582  7.24459      53.7061      38.1933      -11.0577     63.9485    137.425      34.1637   46.1468      
1 1 1 3  8  15 f 1 5.50697  0.417258  -18.685      2.89409      -14.0349     4.60548      10.0997    -82.009      20.9161   1.32714      
1 1 1 3  8  16 o 0 13.2669  0.54778   5.65978      -15.9313     3.58913      2.98991      48.5579    -86.0186     27.5188   -0.883843    
1 1 1 3  8  17 o 0 7.96012  0.221481  -1.41235     -2.79767     0.531501     -0.668233    36.1412    -101.356     44.0277   -145.967     
1 1 1 3  8  18 o 0 6.60229  0.171788  5.20244      5.79417      1.14463      -8.81937     26.413     -71.3918     40.3237   -129.776     
1 1 1 3  8  19 o 0 25.6558  0.845642  11.09        -0.0922054   -4.13772     0.507604     111.215    25.598       18.14     69.2836      
1 1 1 3  8  20 o 0 18.1111  0.218335  1.22496      2.39168      2.00982      -0.534413    72.9243    6.82836      4.13355   101.924      
1 1 1 3  8  21 o 0 9.75445  0.479644  2.27829      -0.72632     -0.636881    0.773493     36.8209    20.0022      2.76441   103.361      
1 1 1 3  9  0  o 0 1.73205  0.22781   -4.60169e-19 -0.00250504  0            0            0.260048   90           21.013    -90          
1 1 1 3  9  1  f 1 45.2068  0.811704  15.9986      -9.84769     -2.57335     5.31032      180.097    -25.7909     17.5888   -2.07406     
1 1 1 3  9  2  o 0 34.229   0.492409  -4.36492     -20.6574     9.07439      -3.84571     171.562    -154.582     82.5101   -135.76      
1 1 1 3  9  3  o 0 15.6652  1.46874   137.942      -6.67677     -37.8503     3.74861      114.738    -4.19811     117.217   -11.2217     
1 1 1 3  9  4  o 0 7.87616  0.353138  -1.58189     28.8442      23.7507      2.52293      14.5959    152.293      63.896    -173.3       
1 1 1 3  9  5  o 0 29.8748  0.231553  -2.94768     0.749384     -6.01993     2.52952      111.123    -88.683      111.76    -7.20274     
1 1 1 3  9  6  o 0 7.49374  0.164821  -6.25514     0.193267     -5.45961     0.402814     37.1326    -35.8087     112.966   -45.7712     
1 1 1 3  9  7  f 1 60.5323  0.675038  -19.4932     -1.0258      -6.76478     -0.402194    243.4      -130.436     37.7664   163.636      
1 1 1 3  9  8  o 0 46.6483  0.205223  1.11307      4.373        12.5293      -3.29458     198.449    -3.14707     38.6401   -33.0816     
1 1 1 3  9  9  f 1 22.3014  1.42918   -85.0478     20.4204      -24.9772     12.9361      41.4436    -176.99      76.224    -22.0007     
1 1 1 3  9  10 o 0 7.80021  0.573084  -9.82124     35.8823      16.2101      9.67847      27.9037    123.732      69.8739   175.879      
1 1 1 3  9  11 f 1 8.62597  0.325312  -4.90082     8.94961      2.81517      4.31305      1.18484    111.441      38.6914   -69.5129     
1 1 1 3  9  12 o 0 16.0036  0.0930612 -4.78682     -2.70257     -3.73184     -6.81561     56.2138    125.373      19.8427   -5.89328     
1 1 1 3  9  13 o 0 14.6385  1.31037   -106.743     -16.7562     -24.2886     -7.93091     57.9128    -153.993     47.0299   -79.0347     
1 1 1 3  9  14 o 0 42.4735  0.398007  -7.50629     -25.8293     14.4641      -7.6163      191.236    -39.5326     50.335    -29.8161     
1 1 1 3  9  15 f 1 15.8533  0.936357  -52.8134     8.0872       -16.9145     5.04339      65.7676    134.554      10.6716   135.31       
1 1 1 3  9  16 o 0 18.2478  0.213421  4.64119      -12.0891     5.50678      5.47642      65.0694    -125.082     28.2826   -22.6478     
1 1 1 3  9  17 o 0 9.97493  0.115191  0.191334     -0.0315721   -0.714749    -0.232603    1.8482     9.31721      73.4145   7.55828      
1 1 1 3  9  18 o 0 3.83277  0.561308  2.74691      7.4014       1.91322      -1.58894     10.0662    56.6112      7.7974    -66.9388     
1 1 1 3  9  19 f 1 47.9586  0.434486  3.16659      -2.29866     -2.32125     1.28785      220.203    -95.7256     46.5664   -90.0241     
1 1 1 3  9  20 o 0 11.364   0.402459  0.595876     4.11011      2.02067      -0.134294    57.4162    27.4995      27.7131   43.9804      
1 1 1 3  10 0  f 1 49.3062  0.284324  9.34334e-18  0.0305177    0            0            196.492    90           60.2281   90           
1 1 1 3  10 1  o 0 43.5781  0.195185  -4.75869     6.22411      1.11837      5.24124      191.942    -164.599     100.297   136.988      
1 1 1 3  10 2  o 0 36.9737  1.15401   -3.61959     -35.1691     9.05557      -2.00368     154.865    -77.9526     88.1939   -146.016     
1 1 1 3  10 3  o 0 92.5934  0.466236  -0.141391    0.566038     -2.79993     -1.01389     420.775    109.685      112.932   99.5717      
1 1 1 3  10 4  o 0 25.0397  0.920275  9.95314      40.4297      12.8693      -6.63735     91.6904    105.405      46.6616   8.97875      
1 1 1 3  10 5  f 1 30.6897  0.912565  22.5231      19.2074      -1.23067     -7.11772     131.15     47.6667      37.5951   13.1821      
1 1 1 3  10 6  o 0 46.3594  0.277436  1.22195      -0.529252    -0.868439    0.673699     173.801    32.5978      16.3634   170.452      
1 1 1 3  10 7  o 0 28.6988  0.813392  15.0244      -23.2533     3.56019      8.29299      111.776    -89.1854     65.7824   -9.2612      
1 1 1 3  10 8  o 0 13.0277  0.664165  -5.64814     35.022       18.1759      5.85628      46.1856    -170.43      52.1707   -92.1208     
1 1 1 3  10 9  o 0 5.21271  1.17839   61.9771      2.75926      -18.0464     -1.63981     64.7419    3.20859      94.4275   3.9101       
1 1 1 3  10 10 o 0 20.1473  1.17401   -50.3337     -60.342      3.46555      -18.1249     85.3246    -127.018     39.193    -73.7526     
1 1 1 3  10 11 o 0 11.5808  0.35441   13.4437      31.1705      20.9076      -21.462      35.5185    -6.77461     30.1058   -37.19       
1 1 1 3  10 12 o 0 27.7875  0.797302  -42.4901     30.1165      -4.91892     13.2757      124.222    121.125      32.1676   137.777      
1 1 1 3  10 13 o 0 22.3249  0.407367  9.919        -6.26874     -4.82635     12.1428      95.262     40.3345      19.5325   6.25943      
1 1 1 3  10 14 o 0 20.8389  1.34682   2.57129      -65.3813     15.7062      1.04059      78.854     -84.9993     1.5148    49.6377      
1 1 1 3  10 15 o 0 19.4097  0.133641  -1.26636     0.116321     -14.1486     -8.44226     67.251     99.2875      25.8002   -20.8013     
1 1 1 3  10 16 o 0 40.4806  0.305204  -1.79704     -1.83791     -0.405533    -1.7167      184.519    -89.27       62.1011   -84.354      
1 1 1 3  10 17 o 0 30.584   0.659766  0.334716     5.58334      1.44631      -0.289583    134.244    54.207       15.9349   65.1628      
1 1 1 3  10 18 o 0 29.183   0.219468  -0.451121    -0.351079    2.06096      1.533        133.852    174.954      39.8756   -145.582     
1 1 1 3  10 19 o 0 15.3721  0.359064  -0.246263    -0.636399    0            0            66.1642    -112.94      11.3608   -112.095     
1 1 1 3  11 0  o 0 62.645   0.353179  -1.6955e-17  -0.0922988   0            0            248.94     90           46.2406   90           
1 1 1 3  11 1  o 0 42.5263  0.594716  -4.5773      -2.07298     -1.15792     -1.12066     194.165    -158.095     58.4898   -156.186     
1 1 1 3  11 2  o 0 28.8155  0.411847  9.33188      12.1395      2.22041      -7.26231     69.5412    -3.64479     86.7395   169.504      
1 1 1 3  11 3  f 1 28.3201  0.826289  -19.4214     -0.470488    -5.3143      -0.160103    59.7874    173.837      98.2232   -9.43099     
1 1 1 3  11 4  o 0 37.9894  0.686782  11.2904      -16.5397     3.26714      7.63263      135.279    -8.06235     46.8762   109.208      
1 1 1 3  11 5  o 0 47.2698  0.652957  2.8743       -6.70946     1.66929      2.13395      156.042    -92.9397     56.279    102.598      
1 1 1 3  11 6  o 0 23.8401  0.836311  38.8734      -5.14787     -17.2913     4.99456      92.5683    -71.3461     30.8722   -155.378     
1 1 1 3  11 7  o 0 10.0162  0.746121  -16.8722     -25.5306     3.6124       -8.37289     11.7505    43.2681      93.2529   49.3194      
1 1 1 3  11 8  o 0 22.6131  0.141826  -0.26504     -0.0196439   7.59238      -6.09809     78.5353    -31.8081     46.4458   -134.033     
1 1 1 3  11 9  o 0 31.0335  0.244913  -6.13682     2.48355      -5.85808     4.31453      124.071    86.6372      14.0499   173.288      
1 1 1 3  11 10 f 1 24.8268  0.199612  7.65956      -8.04103     -0.621142    19.7088      78.3154    -133.345     48.4969   82.6006      
1 1 1 3  11 11 o 0 22.7944  0.647121  1.28685      -28.6714     12.9981      0.835069     80.1113    -140.675     23.6171   2.30673      
1 1 1 3  11 12 f 1 23.0949  0.682222  35.5881      6.05849      -13.7848     -5.18585     111.87     -35.4603     59.9468   2.82431      
1 1 1 3  11 13 o 0 19.9496  1.21787   -36.9564     -39.5155     0.747183     -14.6082     76.4043    -114.751     19.983    159.109      
1 1 1 3  11 14 o 0 13.1293  0.837103  10.395       39.55        11.6812      -6.39314     70.0526    52.1573      49.0002   56.8543      
1 1 1 3  11 15 o 0 7.991    0.472888  -12.2837     6.74344      -2.42543     3.90245      6.10096    104.189      57.6812   18.7115      
1 1 1 3  11 16 o 0 27.372   0.642114  -11.4426     7.26069      -3.10346     4.91171      121.559    96.5813      16.1767   92.848       
1 1 1 3  11 17 o 0 26.6068  0.198129  -1.53353     -2.32008     2.70995      -2.30913     120.218    -174.764     35.3775   139.053      
1 1 1 3  11 18 o 0 14.384   0.198845  -0.317923    0.345278     0            0            66.1166    146.681      20.0545   144.163      
1 1 1 3  12 0  o 0 14.4049  0.106808  -7.76057e-18 -0.0422466   0            0            55.7721    90           23.0945   -90          
1 1 1 3  12 1  o 0 66.7789  0.284773  0.597117     -4.74394     3.92988      2.16548      253.374    -156.846     26.9339   -25.9848     
1 1 1 3  12 2  o 0 62.8149  0.368062  -0.20072     0.0585753    -0.17151     0.265274     244.245    175.002      4.15305   -55.6119     
1 1 1 3  12 3  o 0 20.7628  0.782966  -21.4885     -5.9856      -4.93185     -2.88897     92.6679    -172.61      38.0535   -141.42      
1 1 1 3  12 4  o 0 30.7088  0.290049  3.62998      3.66842      -0.237196    -3.25758     99.2654    -22.5675     39.555    137.582      
1 1 1 3  12 5  o 0 11.8313  0.941515  -29.6856     -59.8391     14.2539      -18.9603     31.7622    -81.4008     16.2875   62.5649      
1 1 1 3  12 6  f 1 25.729   1.01092   -40.9267     1.71587      -11.0754     0.754657     100.173    161.201      14.3351   -98.1803     
1 1 1 3  12 7  o 0 14.5589  1.07762   18.9539      -69.5947     16.2544      9.42227      74.9199    -77.4809     47.6866   -108.723     
1 1 1 3  12 8  o 0 17.2517  0.322267  10.8295      -6.97691     -2.4359      5.82527      81.0389    17.2185      34.8086   -17.9423     
1 1 1 3  12 9  o 0 13.2812  0.433261  16.9231      8.51921      -4.97487     -6.55152     42.7948    -23.7064     18.723    143.989      
1 1 1 3  12 10 o 0 23.6955  0.438017  8.0514       0.503116     -7.69641     -1.69062     74.1367    -67.9561     38.4376   104.748      
1 1 1 3  12 11 o 0 34.4053  0.850855  5.18783      42.5576      16.234       -4.84921     161.661    132.446      54.106    129.267      
1 1 1 3  12 12 o 0 28.5251  0.278581  8.84648      -1.97655     -15.9585     4.67118      136.961    76.1879      56.515    95.8502      
1 1 1 3  12 13 o 0 9.81457  0.888191  20.0024      -32.0719     4.2032       8.73777      20.9517    -23.9398     56.6733   69.5542      
1 1 1 3  12 14 o 0 22.3076  0.866008  10.7812      -13.7276     0.562041     2.56299      83.8992    -47.7752     7.19879   -138.978     
1 1 1 3  12 15 o 0 8.95782  0.75123   10.2081      11.3989      0.578725     -4.186       21.0268    41.2644      28.9593   -159.945     
1 1 1 3  12 16 f 1 18.9145  0.580551  -10.4077     0.461471     -3.7098      0.0764706    80.5664    129.754      20.1777   -164.481     
1 1 1 3  12 17 o 0 15.9679  0.719995  -0.104266    5.41551      1.55508      0.369621     50.0033    99.155       27.7503   -70.614      
1 1 1 3  13 0  o 0 76.1544  0.484081  1.34374e-16  0.438899     0            0            315.408    90           36.6351   90           
1 1 1 3  13 1  f 1 31.2573  0.1613    -0.298351    -2.22398     3.86749      -0.153325    161.285    -12.4274     73.9861   4.53997      
1 1 1 3  13 2  o 0 6.6533   0.6842    20.0942      14.7444      -1.87444     -5.84987     61.3058    4.68596      93.1186   -17.1059     
1 1 1 3  13 3  o 0 33.5614  0.184223  2.55874      -0.130303    -0.390195    -0.000973732 162.928    -38.7038     60.7176   -28.2136     
1 1 1 3  13 4  o 0 21.7593  0.122367  1.42389      -0.967118    -4.22005     6.09298      87.8834    -119.584     22.306    155.043      
1 1 1 3  13 5  o 0 7.24566  0.542429  1.17221      34.886       16.1248      -0.98781     22.8077    75.9589      14.9681   126.76       
1 1 1 3  13 6  o 0 25.8684  1.05791   -63.0697     8.29096      -19.4633     5.54132      113.959    140.17       48.2516   -160.375     
1 1 1 3  13 7  o 0 12.4244  1.0246    13.7241      -49.6399     12.1723      7.12836      40.1926    -69.1294     13.7087   119.713      
1 1 1 3  13 8  o 0 18.6567  0.136905  -0.763212    -0.555869    -0.692146    -1.29699     75.4173    -62.9171     15.6907   -125.615     
1 1 1 3  13 9  o 0 46.3805  0.677409  -0.284041    -2.45465     0.266388     -0.0200224   214.584    -79.4813     64.3582   -81.5433     
1 1 1 3  13 10 o 0 15.5454  0.978546  45.9892      -10.0224     -11.8282     5.58802      49.722     2.35154      19.9766   -152.281     
1 1 1 3  13 11 o 0 33.2196  1.18903   -2.73933     -38.0355     16.1764      -1.56802     147.825    -146.105     45.9168   -114.447     
1 1 1 3  13 12 o 0 28.866   0.820617  -26.0425     -3.57939     -11.7611     -3.96109     98.3821    132.067      33.5243   -92.2956     
1 1 1 3  13 13 f 1 18.8937  0.188294  1.00905      10.4877      11.9987      -3.33124     73.153     162.029      9.07593   -127.162     
1 1 1 3  13 14 o 0 31.6362  0.224331  -0.171008    -0.592438    0.203035     -0.00837822  145.554    -172.58      29.0037   -167.918     
1 1 1 3  13 15 o 0 19.9029  0.357385  -1.43469     -3.21074     0.596363     -0.928712    70.5802    -109.332     21.1664   63.2196      
1 1 1 3  13 16 o 0 10.4511  0.14449   1.02895      -0.370623    -2.15153     -0.481463    42.045     87.6719      21.4896   9.00772      
1 1 1 3  14 0  o 0 3.937    0.123091  6.58178e-18  0.0214977    0            0            0.995457   -90          4.38471   90           
1 1 1 3  14 1  f 1 21.0194  0.757918  -1.23682     -14.5817     4.24287      -0.859976    102.241    -79.5376     39.9137   -76.3491     
1 1 1 3  14 2  f 1 19.9151  0.643835  8.29632      12.5235      2.19453      -5.86203     116.658    101.983      77.9046   108.168      
1 1 1 3  14 3  o 0 33.398   0.231623  -0.0511962   0.0173831    -0.0174708   -0.0332701   124.573    23.8546      19.4128   -156.586     
1 1 1 3  14 4  o 0 11.5611  0.570294  15.4519      -5.55183     -3.31781     2.67706      64.2688    -18.1882     44.6638   -24.4177     
1 1 1 3  14 5  o 0 27.9242  1.36789   6.65832      39.6618      6.7687       -2.51438     114.903    91.487       52.2584   15.7869      
1 1 1 3  14 6  f 1 28.6569  0.367343  10.2674      0.798668     -12.6524     -3.50294     115.125    -71.0611     2.41464   -111.884     
1 1 1 3  14 7  o 0 18.5304  0.818314  -3.2372      -25.4395     6.99457      -1.66641     40.6129    -118.258     63.0562   55.6202      
1 1 1 3  14 8  o 0 18.9674  0.155296  -0.410662    -0.625336    -0.414986    -4.39311     74.6057    136.396      13.6386   -143.621     
1 1 1 3  14 9  o 0 44.8379  0.490824  3.36995      -5.20733     0.485511     0.764605     181.166    -133.074     31.0566   -69.3685     
1 1 1 3  14 10 o 0 12.4244  1.17215   -48.5498     19.8346      -10.3114     9.89758      43.1699    148.455      7.00389   -64.398      
1 1 1 3  14 11 o 0 12.2142  0.126997  1.51367      -8.65959     16.976       4.9508       56.1656    9.67663      25.8254   48.7908      
1 1 1 3  14 12 o 0 38.8912  0.544919  14.2889      3.49951      -7.67752     -2.25021     158.263    64.7755      23.3356   -179.004     
1 1 1 3  14 13 o 0 5.96959  0.205505  0.371733     2.26995      1.85712      -0.460654    7.75175    -5.96584     31.2032   -147.645     
1 1 1 3  14 14 o 0 13.6738  0.361576  0.587362     1.21764      0.120786     -0.361811    56.5048    36.175       5.31101   61.1048      
1 1 1 3  14 15 o 0 16.5521  0.164783  -0.576109    0.213288     0.65844      0.714955     86.9865    25.8535      43.0021   28.6334      
1 1 1 3  14 16 o 0 15.802   1.69546   -11.1282     2.0897       -1.43952     0.754617     53.0525    161.241      24.8045   -61.613      
1 1 1 3  15 0  o 0 57.937   0.670518  -6.69915e-17 -0.364685    0            0            237.023    90           4.58256   90           
1 1 1 3  15 1  o 0 39.8524  0.940447  3.95744      -7.28268     1.82616      2.21903      180.663    -62.353      40.4682   -57.8992     
1 1 1 3  15 2  o 0 5.43082  0.334928  2.84456      -4.01245     0.404061     1.17883      52.6703    -42.1033     90.5717   -22.765      
1 1 1 3  15 3  f 1 34.8299  0.645486  5.91463      1.1408       -3.06399     -0.681692    153.438    58.6131      30.917    79.095       
1 1 1 3  15 4  o 0 15.1927  0.301292  2.88295      2.4506       -0.477037    -1.98162     39.5008    -8.3675      41.5229   -153.737     
1 1 1 3  15 5  o 0 32.8363  0.244807  -1.25776     -3.53769     5.02611      -1.98897     108.24     177.595      47.6504   -27.0858     
1 1 1 3  15 6  o 0 33.8492  0.275868  -2.2743      1.1462       -2.33534     1.71266      129.213    66.017       39.4777   163.201      
1 1 1 3  15 7  o 0 23.5386  1.29955   22.0829      -29.2557     2.19333      8.74901      109.513    -72.2378     37.4879   -59.0986     
1 1 1 3  15 8  o 0 17.7332  0.508968  -4.26318     8.45076      2.13787      3.2452       88.1743    161.015      42.7491   165.414      
1 1 1 3  15 9  o 0 20.1779  0.458815  6.26358      2.71267      -2.38163     -2.85641     72.6667    32.1818      6.37167   176.586      
1 1 1 3  15 10 o 0 22.1517  0.385845  -7.41918     -4.90909     -1.74643     -3.11457     112.401    -101.428     39.8877   -96.402      
1 1 1 3  15 11 o 0 47.4475  0.350034  1.73909      1.01561      5.13613      -0.530319    215.119    14.3528      38.5309   -20.8571     
1 1 1 3  15 12 o 0 16.0453  0.381699  4.78059      -0.289193    -4.1182      -0.154556    71.7715    -71.6412     11.4982   -69.5436     
1 1 1 3  15 13 f 1 13.2695  0.141895  0.671722     -0.313398    0.690566     1.34873      55.8603    22.1525      8.06128   69.9159      
1 1 1 3  15 14 o 0 16.4851  0.150662  -0.327428    0.45658      0.603177     -0.366907    73.6238    150.535      16.2513   160.914      
1 1 1 3  16 0  o 0 2.07364  0.398119  -1.68252e-18 -0.00915923  0            0            2.99593    90           29.1484   -90          
1 1 1 3  16 1  o 0 21.9121  0.246609  0.719171     0.411525     -1.1099      -0.709897    75.2323    -45.7882     26.673    164.614      
1 1 1 3  16 2  o 0 31.6332  0.452413  -0.984411    -4.12111     3.89624      -3.76741     138.582    -36.196      26.2942   -15.7132     
1 1 1 3  16 3  o 0 17.7745  0.29123   4.20239      1.11368      -3.91261     -1.6574      67.7477    -62.601      13.0453   -169.692     
1 1 1 3  16 4  o 0 14.593   0.514456  7.21841      -8.59547     0.943598     4.59102      44.413     -5.30297     34.7901   -134.504     
1 1 1 3  16 5  o 0 26.6017  0.263495  0.920313     -1.80134     0.905748     0.667079     111.06     -73.3236     15.2631   -67.9999     
1 1 1 3  16 6  o 0 12.5859  0.622506  12.4217      4.62741      -4.00241     -3.12126     44.2582    -17.3283     29.8833   79.2312      
1 1 1 3  16 7  o 0 12.5484  0.66018   -9.77226     -6.2385      -1.38675     -2.71057     63.1616    -166.219     29.2152   -136.301     
1 1 1 3  16 8  f 1 7.51296  0.459762  2.1339       9.27008      3.90817      -2.06579     18.5724    138.46       26.972    -103.134     
1 1 1 3  16 9  o 0 41.3275  0.71049   -8.06227     0.807646     -2.0612      1.03142      184.28     -152.094     19.0438   -152.137     
1 1 1 3  16 10 o 0 33.7347  0.808996  1.77747      -2.93056     -0.542552    1.39547      148.207    -95.6012     13.838    -102.625     
1 1 1 3  16 11 o 0 10.2644  0.487162  0.777894     -1.84526     0.421986     0.628473     37.2562    -80.947      5.57617   137.603      
1 1 1 3  16 12 o 0 18.4129  1.14751   -7.89138     -4.47359     -1.15335     -1.36328     67.1437    -121.622     20.2974   101.313      
1 1 1 3  17 0  o 0 17.3003  0.242245  1.84888e-17  0.0603889    0            0            77.109     -90          2.13952   -90          
1 1 1 3  17 1  f 1 7.58288  0.186573  -0.0832125   -0.0775165   0            0            21.0216    100.938      5.09568   -109.602     
1 1 1 3  17 2  o 0 9.13236  0.208702  0.20215      -0.0907453   0            0            32.4059    93.4464      14.7725   81.4322      
1 1 1 3  17 3  o 0 28.0548  1.02129   -10.5236     -1.4228      -2.81733     -0.441114    135.551    157.63       28.9284   169.613      
1 1 1 3  17 4  o 0 43.274   0.369035  0.652671     1.43985      1.33989      0.225169     206.906    173.371      38.264    170.447      
1 1 1 3  17 5  o 0 19.0876  0.562803  1.86348      4.33582      0.682378     -0.625557    77.0899    102.87       16.1345   -11.3242     
1 1 1 3  17 6  o 0 13.5523  0.16684   -0.2251      0.826884     0.798545     0.192932     60.4217    172.35       8.57171   165.545      
1 1 1 3  17 7  o 0 22.3659  0.672007  5.0473       -1.91839     -0.720191    1.20623      97.9522    -8.49542     8.59476   17.9924      
1 1 1 3  17 8  o 0 21.6585  0.97457   -3.12362     9.37449      2.4002       1.05974      66.9121    106.152      48.1455   -84.9791     
1 1 1 3  17 9  o 0 17.832   0.789293  -4.38353     -0.429047    -1.29655     -0.680662    62.2802    160.566      23.1158   -3.53686     
1 1 1 3  17 10 o 0 11.4548  0.227012  0.198405     2.0002       1.07382      -0.720215    35.8906    145.084      33.3923   27.0039      
1 1 1 4  0  0  o 0 28.3619  0.268928  0.0575526    0            0            0            114.641    0            19.9612   180          
1 1 1 4  0  1  o 0 38.559   0.247377  1.56975e-16  0.512721     0            0            164.656    -90          41.9676   -90          
1 1 1 4  0  2  o 0 74.4641  0.438562  0.434318     0            0            0            324.406    180          59.2501   -0           
1 1 1 4  0  3  o 0 40.7321  0.25859   -2.68997e-17 -0.146435    0            0            180.006    90           30.6902   -90          
1 1 1 4  0  4  o 0 17.3839  0.153947  -0.0621027   7.60539e-18  0            0            73.112     180          26.4553   -0           
1 1 1 4  0  5  o 0 42.5241  0.303535  -7.26764e-17 -0.395632    0            0            190.664    -90          10.1333   90           
1 1 1 4  0  6  o 0 66.5605  0.461035  -0.6199      7.59159e-17  0            0            288.307    0            19.1656   180          
1 1 1 4  0  7  o 0 53.4537  0.379865  -3.13038e-17 -0.17041     0            0            230.703    -90          31.2141   90           
1 1 1 4  0  8  o 0 58.6387  0.450156  0.0360455    0            0            0            251.723    0            43.2146   0            
1 1 1 4  0  9  o 0 82.7587  0.683088  3.64007e-17  0.118894     0            0            336.061    -90          27.6929   -90          
1 1 1 4  0  10 o 0 16.8167  0.17362   0.0209831    0            0            0            59.6304    -180         17.3554   1.23042e-15  
1 1 1 4  0  11 o 0 30.8642  0.241109  4.25851e-17  0.139093     0            0            123.367    -90          17.4005   90           
1 1 1 4  0  12 o 0 27.1109  0.223157  0.0591354    0            0            0            106.432    180          26.5028   -180         
1 1 1 4  0  13 o 0 6.14817  0.15851   9.39544e-19  0.00306878   0            0            0.252518   90           0.828848  -90          
1 1 1 4  0  14 o 0 6.54217  0.134764  0.0297916    0            0            0            10.7962    0            20.5907   180          
1 1 1 4  0  15 o 0 47.7336  0.302888  -4.35322e-17 -0.236978    0            0            185.882    90           14.2603   90           
1 1 1 4  0  16 o 0 13.8275  0.132515  -0.110457    1.3527e-17   0            0            55.2803    0            40.3121   180          
1 1 1 4  0  17 o 0 7.97496  0.135606  -1.30663e-17 -0.0711299   0            0            26.2719    -90          7.72265   90           
1 1 1 4  0  18 o 0 50.4004  0.319396  -0.502811    6.15766e-17  0            0            199.846    180          3.77322   -180         
1 1 1 4  0  19 o 0 11.2517  0.131762  -1.19127e-17 -0.0648498   0            0            43.5627    90           12.7093   -90          
1 1 1 4  0  20 o 0 13.2476  0.134501  0.0117769    0            0            0            51.3192    180          16.0047   -0           
1 1 1 4  0  21 o 0 18.4499  0.15586   8.96809e-17  0.29292      0            0            78.1149    90           1.97143   90           
1 1 1 4  0  22 o 0 3.01662  0.300117  0.0220694    0            0            0            4.55152    0            10.7725   180          
1 1 1 4  1  0  o 0 26.2564  0.181553  0.324665     0            0            0            107.278    -180         1.41033   2.19279e-12  
1 1 1 4  1  1  o 0 42.5516  1.80595   100.238      -33.9431     -17.5602     13.0916      215.524    -19.9503     78.2719   -16.085      
1 1 1 4  1  2  o 0 13.1165  1.56873   -58.5869     146.167      26.927       25.8454      62.6996    109.489      16.2494   96.0113      
1 1 1 4  1  3  o 0 69.656   1.3554    6.33944      19.093       3.68413      -3.21189     321.773    51.7204      47.9311   76.6556      
1 1 1 4  1  4  o 0 48.5472  0.83941   6.37243      32.0718      19.7871      -9.16802     213.967    -4.16367     152.222   -83.3663     
1 1 1 4  1  5  o 0 33.2749  1.03629   41.8659      9.4264       -12.91       -5.95611     113.6      27.3307      53.0184   170.493      
1 1 1 4  1  6  o 0 25.3114  2.20864   5.77105      213.527      54.6944      -3.22076     84.1524    100.468      68.4939   -139.716     
1 1 1 4  1  7  o 0 53.4571  1.02375   -15.0785     10.6798      -2.005       5.08509      273.55     172.681      99.1793   168.559      
1 1 1 4  1  8  o 0 18.1956  0.256179  -1.89584     0.067844     -0.996668    0.0999615    69.4487    -173.367     39.4683   -174.228     
1 1 1 4  1  9  o 0 30.4358  0.753223  -0.951307    -8.09433     1.754        -0.448661    119.552    -106.757     18.1259   -38.329      
1 1 1 4  1  10 o 0 90.2132  1.18565   -4.82582     -12.1185     2.28199      -2.57205     401.759    -72.5217     86.3303   -83.2281     
1 1 1 4  1  11 o 0 46.002   1.57754   -51.5149     4.74179      -9.79264     1.97216      234.477    174.366      110.756   -178.307     
1 1 1 4  1  12 o 0 24.8132  0.817919  2.66212      -28.7937     7.72845      1.39019      61.0378    -82.9816     64.4786   93.5013      
1 1 1 4  1  13 o 0 32.1256  0.433348  -7.37361     5.41086      -1.90015     7.0867       149.573    72.6014      49.4781   80.0048      
1 1 1 4  1  14 o 0 25.7913  0.687222  -11.77       -7.99448     -0.935165    -2.44354     64.422     -149.212     69.9865   13.4165      
1 1 1 4  1  15 f 1 29.3527  0.31458   -2.11698     -3.80477     1.05734      -1.47767     109.966    -70.6662     1.29994   59.7611      
1 1 1 4  1  16 o 0 9.34245  1.52727   32.0068      129.223      28.951       -15.3887     33.539     11.5212      81.2006   -46.5288     
1 1 1 4  1  17 o 0 5.51317  1.11007   56.1765      -15.7015     -11.6505     7.0901       40.6734    0.436447     44.0163   18.7057      
1 1 1 4  1  18 o 0 6.34002  0.958505  -0.940487    45.1311      13.5317      0.49934      19.6828    92.8385      4.36403   -76.3461     
1 1 1 4  1  19 o 0 25.3565  0.577294  -19.7819     13.2871      -5.07231     10.8225      121.393    90.4319      55.0365   119.146      
1 1 1 4  1  20 o 0 32.0018  0.558238  -8.77778     -9.22837     -0.0991023   -4.20937     106.206    -81.6248     37.6891   130.272      
1 1 1 4  1  21 o 0 8.73621  0.200885  2.16618      1.0035       -0.839697    -1.19936     26.0801    84.3179      16.021    -82.6072     
1 1 1 4  1  22 o 0 25.8668  1.13747   6.65461      30.8106      10.9182      -4.2128      119.433    116.152      28.8237   140.792      
1 1 1 4  1  23 o 0 28.0183  2.28377   12.196       -3.78702     -1.52489     0.615297     124.53     -73.8779     48.6028   -14.3626     
1 1 1 4  2  0  f 1 21.9704  0.193997  -0.0862275   1.05598e-17  0            0            90.1605    180          68.0798   -5.81797e-14 
1 1 1 4  2  1  o 0 24.6483  1.01228   -101.097     -16.4196     -59.3102     -19.1594     178.699    -116.44      175.808   -125.562     
1 1 1 4  2  2  o 0 44.1236  1.904     75.7814      29.4927      -16.9391     -14.9332     203.87     9.08783      46.7919   29.392       
1 1 1 4  2  3  o 0 17.8846  0.499843  7.90877      -24.8022     14.0439      9.65036      78.0671    -139.218     34.3283   -162.095     
1 1 1 4  2  4  o 0 46.5145  0.846043  24.1425      -15.4197     -6.28835     14.8571      204.101    34.7314      58.4824   116.251      
1 1 1 4  2  5  o 0 17.8599  0.80148   80.6181      -27.4223     -41.6463     32.4663      104.199    -65.575      83.4101   -35.0075     
1 1 1 4  2  6  o 0 57.092   0.519751  3.39192      8.33709      4.71679      -3.80061     279.749    2.31746      78.8177   6.43452      
1 1 1 4  2  7  o 0 33.6242  0.789985  13.0276      9.59789      -2.18251     -6.3833      162.021    86.0091      53.8997   113.592      
1 1 1 4  2  8  o 0 17.6107  1.26955   42.7312      2.93176      -11.3259     -1.6195      83.2182    -1.74162     44.8098   -46.2937     
1 1 1 4  2  9  o 0 56.3318  0.796914  6.07703      -11.4452     2.00683      3.14435      253.813    -109.993     87.8603   -67.9313     
1 1 1 4  2  10 o 0 57.219   1.02075   -13.5396     11.9963      -0.345667    3.82459      229.901    129.911      17.2595   -177.923     
1 1 1 4  2  11 o 0 71.9181  0.936816  -11.8666     5.25985      -2.53944     3.18593      308.134    133.925      53.5202   131.186      
1 1 1 4  2  12 o 0 14.2499  0.647772  -34.0064     -27.7055     -3.66074     -18.0902     43.6893    -140.73      90.1606   -63.9461     
1 1 1 4  2  13 o 0 63.1661  0.290774  1.26807      2.27012      0.484106     -0.697628    256.036    114.346      18.7308   102.77       
1 1 1 4  2  14 o 0 7.52017  0.960398  44.0274      13.5663      -11.525      -7.79634     20.5548    -47.6989     60.7327   -105.62      
1 1 1 4  2  15 o 0 21.3646  0.535425  12.2378      -17.8637     5.65215      13.5824      60.3167    18.9558      47.5535   169.411      
1 1 1 4  2  16 o 0 31.318   0.24031   -0.689523    6.11287      4.04941      1.40931      148.115    164.858      52.293    -178.891     
1 1 1 4  2  17 o 0 23.4629  1.30957   -73.1797     16.9083      -15.0445     7.18232      93.4964    169.579      30.6824   90.2938      
1 1 1 4  2  18 o 0 24.3771  0.988404  -26.8343     -27.506      0.0426352    -12.596      70.1239    -170.489     50.1295   26.0096      
1 1 1 4  2  19 o 0 30.2913  0.211308  2.19071      3.538        1.22988      -5.97286     116.706    131.346      5.63756   42.1461      
1 1 1 4  2  20 o 0 33.2977  0.276525  -7.37469     -0.938666    -7.80973     -0.6996      137.979    -101.54      21.8546   -95.7698     
1 1 1 4  2  21 o 0 10.59    0.607046  12.7858      -9.28584     -2.61139     7.1964       29.8029    -97.3101     28.5911   102.282      
1 1 1 4  2  22 o 0 13.7471  0.87557   0.0421129    -4.2281      0.801116     0.120988     69.2002    -90.0731     30.4669   -92.5622     
1 1 1 4  2  23 o 0 18.4499  0.454777  -0.0206477   -1.04068     0            0            81.9757    -54.9055     17.4027   -67.9867     
1 1 1 4  3  0  f 1 8.11788  0.121357  -0.062498    7.6538e-18   0            0            6.4819     180          9.11503   -9.22172e-14 
1 1 1 4  3  1  o 0 63.7281  1.05715   13.5923      -18.5715     3.12509      8.13495      247.241    -12.9936     56.0029   112.023      
1 1 1 4  3  2  o 0 29.428   1.51064   86.2171      -49.6699     -13.6506     22.9809      136.077    -27.1193     66.7651   -83.0394     
1 1 1 4  3  3  o 0 43.6202  0.702803  -2.43975     -29.9934     37.087       -8.39175     229.169    -175.177     84.2859   -177.206     
1 1 1 4  3  4  o 0 15.2663  0.948526  54.5677      47.9362      -3.04388     -23.9789     94.582     43.1274      87.0088   32.9491      
1 1 1 4  3  5  o 0 48.1135  0.550572  -8.05848     -8.16663     -0.475058    -7.47978     201.887    157.03       75.6055   75.1365      
1 1 1 4  3  6  o 0 39.5118  0.212292  0.0466787    -4.08519     4.27815      -0.313555    167.743    -16.0527     45.9147   60.1392      
1 1 1 4  3  7  o 0 23.7998  0.183107  0.902819     -5.44816     13.3693      5.72981      68.4059    9.3135       63.4188   178.168      
1 1 1 4  3  8  o 0 9.39086  0.824076  -22.7094     2.19514      -7.42017     1.42152      28.8725    -140.906     63.0369   -78.1288     
1 1 1 4  3  9  o 0 42.9093  1.22425   -6.80278     -32.6923     9.45045      -3.93911     149.017    -76.3423     37.0471   88.4522      
1 1 1 4  3  10 o 0 56.2256  1.32329   36.2551      8.35127      -8.64707     -3.92723     199.02     20.7511      41.405    -167.041     
1 1 1 4  3  11 o 0 51.5248  0.254106  1.39633      -0.33081     -1.23931     0.997709     221.926    36.2483      56.434    67.7725      
1 1 1 4  3  12 o 0 72.5011  0.336074  2.74064      -2.2296      -0.191929    0.533518     258.804    -81.9893     53.3579   76.8743      
1 1 1 4  3  13 o 0 20.6592  0.117278  -0.0742392   2.56142      17.8332      3.86673      13.1001    61.3327      147.089   179.168      
1 1 1 4  3  14 o 0 8.99417  0.912392  43.6752      -0.485997    -12.5403     0.236045     56.5966    -21.7414     75.005    -53.5645     
1 1 1 4  3  15 o 0 28.6141  1.11317   9.86732      51.3834      11.3957      -4.29713     120.574    70.4384      62.4152   129.712      
1 1 1 4  3  16 o 0 20.4738  0.554028  22.4937      16.5162      -3.11135     -10.446      120.818    77.186       88.9824   59.4942      
1 1 1 4  3  17 o 0 36.1225  0.73671   -8.70192     10.5908      0.804587     3.13918      119.457    140.272      44.3066   -40.4654     
1 1 1 4  3  18 o 0 50.3128  0.85354   -2.16903     14.4222      3.21791      1.28483      196.948    67.5025      7.00133   139.324      
1 1 1 4  3  19 o 0 15.913   1.32236   16.4537      -95.0976     23.8058      8.73567      58.9866    -80.7284     13.5677   -168.905     
1 1 1 4  3  20 o 0 20.6815  1.07678   55.1175      1.17963      -13.5957     -0.343722    60.4283    12.5607      61.4088   -101.788     
1 1 1 4  3  21 o 0 4.20228  0.876437  4.96003      12.6465      2.2377       -2.11126     16.0305    87.1302      12.0387   163.404      
1 1 1 4  3  22 o 0 23.9737  0.786298  3.04966      7.40468      1.18611      -2.10576     99.0272    107.39       4.1223    58.3166      
1 1 1 4  3  23 o 0 10.9309  0.642298  -2.01869     2.3482       -0.0137184   0.795181     49.2488    110.359      16.2552   114.24       
1 1 1 4  4  0  o 0 26.5424  0.200051  0.0771401    0            0            0            110.214    180          15.4197   -3.08899e-13 
1 1 1 4  4  1  f 1 20.7452  1.03591   -43.247      -34.8758     -2.95757     -13.9212     61.532     -121.431     97.607    -23.3669     
1 1 1 4  4  2  o 0 11.4311  2.23197   260.854      3.76161      -0.783246    -1.98624     70.1009    -40.4714     91.8487   -83.9181     
1 1 1 4  4  3  o 0 67.5592  1.63951   -1.62129     -43.8184     10.185       -0.280816    327.575    -110.246     85.5598   -95.5815     
1 1 1 4  4  4  o 0 30.1554  1.78083   66.5104      -14.6211     -15.9122     7.21874      106.786    -12.9354     34.8627   -155.545     
1 1 1 4  4  5  o 0 101.416  0.491941  0.999404     -3.51254     0.758829     0.887991     502.838    -155.5       164.616   -144.843     
1 1 1 4  4  6  o 0 63.1389  0.562068  -1.76112     -0.173714    -0.586096    -0.176661    219.111    -117.812     85.6106   66.7663      
1 1 1 4  4  7  o 0 15.6252  1.14745   -1.90518     -32.0157     7.29138      -0.926867    90.8326    -86.8333     64.2729   -67.518      
1 1 1 4  4  8  f 1 60.6514  1.42897   -31.4771     5.00884      -11.4223     3.33809      279.776    -140.261     103.181   -175.592     
1 1 1 4  4  9  o 0 52.9706  1.18412   4.60147      31.4083      8.00895      -2.26857     200.71     58.0057      27.5302   173.409      
1 1 1 4  4  10 o 0 71.0954  0.39079   -6.06175     1.57498      -3.85962     1.45932      298.826    102.566      42.197    98.3618      
1 1 1 4  4  11 o 0 54.2479  0.24465   -0.147927    -0.362913    -0.134888    -2.11169     177.613    -64.4428     86.5846   73.5002      
1 1 1 4  4  12 o 0 56.8027  0.462012  -8.33839     0.860709     -5.15732     1.8187       241.349    120.291      78.983    68.3011      
1 1 1 4  4  13 o 0 9.99984  0.166102  -0.186235    4.78714      5.60887      0.369585     30.4104    -154.46      47.3306   -97.6522     
1 1 1 4  4  14 o 0 29.5589  0.348129  -12.0506     1.64765      -20.6271     7.16119      64.9278    96.2403      100.631   -103.145     
1 1 1 4  4  15 o 0 53.4653  0.236723  -3.03284     -11.3848     10.5623      -3.4668      230.328    -174.982     81.931    -113.515     
1 1 1 4  4  16 o 0 23.9872  0.271212  6.15674      -0.377623    -1.85816     0.176854     93.1044    33.6947      19.8411   -44.086      
1 1 1 4  4  17 o 0 9.48742  0.0912219 1.07723      -0.687221    -0.59628     1.0771       13.1836    147.574      87.2272   -171.419     
1 1 1 4  4  18 o 0 10.0452  1.02107   -50.7864     2.43334      -13.4855     1.21571      4.15599    177.272      65.653    -5.69695     
1 1 1 4  4  19 o 0 22.9552  0.83386   19.3266      37.1428      6.84283      -9.29947     107.763    31.5029      60.3568   72.856       
1 1 1 4  4  20 o 0 28.301   1.75147   -49.8873     4.48102      -11.4974     1.5592       104.393    165.599      3.96758   -13.6547     
1 1 1 4  4  21 o 0 17.4326  0.240466  1.61172      -5.94463     3.35742      1.6269       75.5592    -12.1956     10.2536   -36.5354     
1 1 1 4  4  22 o 0 4.45777  0.203716  -0.358964    0.286975     -0.108367    0.184474     6.49411    139.959      30.5783   84.0008      
1 1 1 4  5  0  o 0 77.8158  0.476411  0.123948     0            0            0            315.197    180          4.68051   -180         
1 1 1 4  5  1  o 0 28.2513  0.475463  4.95534      30.1547      19.4716      -6.95792     156.011    -2.8182      119.993   -38.7166     
1 1 1 4  5  2  o 0 23.8531  1.08964   35.2003      0.266068     -13.9845     -0.0356786   119.557    44.9903      50.6843   29.8477      
1 1 1 4  5  3  o 0 8.49107  2.30262   3.10742      144.497      39.2614      -1.74804     13.1861    54.6674      46.8626   -69.5195     
1 1 1 4  5  4  o 0 73.3675  0.444153  6.55892      -1.07189     -3.07629     1.27144      304.967    67.5466      73.4591   -14.9896     
1 1 1 4  5  5  o 0 37.0038  0.363896  0.0373185    -3.3091      3.92969      0.514377     191.658    -163.539     81.7832   -161.136     
1 1 1 4  5  6  o 0 87.1512  0.448354  0.529138     0.587347     0.754827     -0.629545    385.383    104.395      85.2231   111.371      
1 1 1 4  5  7  o 0 31.001   1.4374    -17.3922     -39.7436     6.95883      -7.70433     113.136    -113.18      96.1546   160.38       
1 1 1 4  5  8  o 0 48.8737  0.668529  -15.4046     -0.281523    -5.74752     -0.0242914   196.755    138.596      18.0927   100.241      
1 1 1 4  5  9  o 0 77.437   0.578503  -2.1639      -12.5228     6.34474      -2.92968     310.164    -51.3698     59.2618   21.1769      
1 1 1 4  5  10 o 0 84.0337  0.405439  3.77627      -4.25564     -0.512333    4.63643      320.271    -121.62      38.4118   -11.7812     
1 1 1 4  5  11 f 1 71.548   0.483883  3.96291      -0.250833    -1.3925      0.431546     301.271    32.6333      46.3055   39.3797      
1 1 1 4  5  12 o 0 56.0795  0.834977  -8.34515     -11.5266     1.48903      -3.69253     215.307    -114.583     4.00065   105.135      
1 1 1 4  5  13 o 0 35.9655  1.07815   14.9929      35.9193      9.35048      -9.78952     148.929    108.3        32.533    149.965      
1 1 1 4  5  14 o 0 19.1186  0.903355  44.3432      -8.0117      -14.1987     5.48833      79.8225    -39.9738     31.9079   12.743       
1 1 1 4  5  15 o 0 16.3215  1.13219   1.57         -84.4229     22.4768      0.999357     45.616     -85.859      43.9639   45.6963      
1 1 1 4  5  16 o 0 12.8862  0.515876  13.9075      -16.1102     1.50233      9.39606      38.8585    8.48403      23.5899   166.072      
1 1 1 4  5  17 o 0 7.21172  0.346087  -5.12646     -4.30815     -0.381073    -2.05733     12.107     -145.722     26.3522   71.5111      
1 1 1 4  5  18 o 0 37.4686  0.181062  0.736699     -0.29811     -1.06834     0.595142     155.837    33.5516      27.3174   55.2579      
1 1 1 4  5  19 o 0 25.0786  1.40457   23.0776      88.1372      24.2164      -13.0731     79.0755    98.8072      33.9971   -109.479     
1 1 1 4  5  20 o 0 22.6893  1.0756    20.3405      -9.2397      -4.2418      4.30417      89.6761    -49.325      7.4639    114.045      
1 1 1 4  5  21 o 0 19.814   0.862244  0.154754     16.6678      6.52239      0.267367     77.67      39.9498      10.5896   164.609      
1 1 1 4  5  22 o 0 22.3243  0.196169  -0.975387    -0.744904    -0.207474    -0.154252    81.9337    4.82691      15.8264   -156.278     
1 1 1 4  6  0  o 0 6.52687  0.0906597 -0.00153732  1.88268e-19  0            0            2.43153    180          10.5206   -0           
1 1 1 4  6  1  o 0 19.8543  0.42584   5.2212       -6.08399     0.847536     4.87908      69.4366    20.3754      29.0869   140.653      
1 1 1 4  6  2  o 0 28.4807  1.15757   -54.1812     15.9564      -19.7642     12.45        119.588    108.108      19.9756   40.8241      
1 1 1 4  6  3  o 0 56.7065  0.814304  3.16115      18.2471      7.0157       -2.17488     245.876    29.0116      45.3532   78.4187      
1 1 1 4  6  4  o 0 21.2148  0.55424   22.0933      3.25862      -15.82       -4.53236     73.4447    74.934       28.5436   -87.0293     
1 1 1 4  6  5  f 1 26.8592  0.902543  16.4199      6.32394      -4.09885     -3.79795     31.895     6.54028      149.489   154.196      
1 1 1 4  6  6  f 1 61.8085  0.297022  -0.453984    0.091135     3.78469      0.697316     321.573    -177.145     161.688   -174.186     
1 1 1 4  6  7  o 0 42.651   1.63292   41.417       -44.4327     0.788313     13.1994      112.775    -47.3236     122.496   95.5407      
1 1 1 4  6  8  o 0 81.1504  1.13691   -13.8915     4.27798      -3.71801     2.90462      309.32     146.801      14.3234   -18.0394     
1 1 1 4  6  9  o 0 23.3838  0.899674  -22.9043     -39.4799     6.27025      -10.8606     72.7124    -119.323     31.7531   98.6152      
1 1 1 4  6  10 o 0 16.9577  0.274195  -10.6112     -5.67288     -7.8306      -11.3734     33.2238    -72.0656     33.4458   -23.8808     
1 1 1 4  6  11 o 0 25.6304  1.82923   -99.4337     1.35601      -21.6538     0.422933     130.956    177.677      66.2399   170.79       
1 1 1 4  6  12 o 0 46.3082  0.29985   -4.89016     11.0553      3.53413      4.34342      187.846    50.5084      63.7021   117.947      
1 1 1 4  6  13 o 0 13.814   0.877503  19.0393      -24.9808     2.4018       8.56025      51.0473    -51.3433     7.45106   -15.884      
1 1 1 4  6  14 o 0 39.1559  1.20525   35.55        -13.5102     -9.35377     8.96476      139.75     -34.5078     28.3391   172.303      
1 1 1 4  6  15 o 0 42.8546  0.901943  -14.2893     -12.8023     -1.64623     -8.92761     176.34     -87.2598     54.7102   -19.1501     
1 1 1 4  6  16 o 0 16.5966  0.946568  -26.494      -29.3391     1.00209      -8.60215     82.2627    -133.773     38.7488   -132.643     
1 1 1 4  6  17 o 0 20.64    0.845751  23.0509      -4.46641     -5.23631     2.00395      90.8655    -31.9363     40.3604   14.6297      
1 1 1 4  6  18 o 0 18.2219  1.33082   -48.6345     41.5228      -1.79502     12.116       58.2421    131.145      44.9646   22.1744      
1 1 1 4  6  19 o 0 6.67324  0.685175  -3.30796     -23.9521     6.50673      -1.77929     8.28999    -127.667     34.6239   106.981      
1 1 1 4  6  20 o 0 7.72818  0.564377  17.8786      -0.514244    -11.8167     0.296127     36.4168    -70.4769     12.5826   -90.6644     
1 1 1 4  6  21 o 0 7.90673  0.256079  -0.803263    -0.434648    -0.10987     -0.83743     28.7322    156.496      7.226     68.0202      
1 1 1 4  6  22 o 0 17.9531  0.213433  -1.04596     -0.996215    -0.411615    -0.602544    63.0817    -91.7886     16.0614   82.8452      
1 1 1 4  7  0  o 0 75.9763  0.433185  0.137095     0            0            0            295.834    180          65.3638   -180         
1 1 1 4  7  1  o 0 105.588  1.32674   -8.72836     -8.28614     -0.697161    -3.78805     420.276    -145.224     20.573    -133.705     
1 1 1 4  7  2  o 0 50.6329  1.77127   27.5563      19.1532      -1.64299     -4.65506     147.433    35.3164      110.99    -111.031     
1 1 1 4  7  3  o 0 44.8596  1.25057   3.43844      -31.2337     11.6442      2.32483      151.925    -36.3054     45.9325   127.117      
1 1 1 4  7  4  o 0 54.5905  1.11707   10.4748      -13.9344     1.02241      3.95595      185.536    -64.4174     51.7177   110.299      
1 1 1 4  7  5  o 0 73.7069  0.333782  1.17311      -0.605011    -0.755721    3.57906      305.95     43.298       38.4194   58.8399      
1 1 1 4  7  6  o 0 67.7057  0.99125   -7.55282     -29.002      13.0885      -6.55364     287.259    -162.261     51.5858   -135.409     
1 1 1 4  7  7  o 0 71.4807  0.315844  -2.17299     -0.374935    -4.4725      -4.14446     306.874    116.246      57.5753   118.83       
1 1 1 4  7  8  f 1 78.3174  1.40964   -17.6577     -9.51924     -1.4281      -2.30869     333.41     -150.199     53.5987   -155.56      
1 1 1 4  7  9  o 0 23.6146  0.130919  -0.0863067   -8.98678     7.60772      0.00908905   101.069    -162.144     19.7607   -165.385     
1 1 1 4  7  10 o 0 37.1682  1.66053   5.24866      -56.2938     13.5646      2.3454       160.307    -68.6985     47.8514   -109.757     
1 1 1 4  7  11 o 0 5.68788  0.0987665 4.79001      -0.9992      -17.9117     7.08031      47.7069    172.1        99.9526   160.595      
1 1 1 4  7  12 o 0 20.9726  1.51028   -23.4299     -86.7439     23.4692      -13.8642     36.3523    -107.79      75.952    70.4417      
1 1 1 4  7  13 o 0 48.0179  0.69894   -6.2996      -4.6594      -2.02986     -4.6669      186.548    -119.966     41.384    -50.8735     
1 1 1 4  7  14 o 0 35.3458  0.179537  1.34894      -0.286055    -1.88357     0.200269     142.032    -87.6547     16.6901   -27.5913     
1 1 1 4  7  15 o 0 16.4874  0.547405  7.92685      -13.0285     3.85052      6.89706      70.2648    -117.978     13.0903   -106.885     
1 1 1 4  7  16 o 0 27.8892  0.960166  0.0979861    -50.2688     15.7664      0.476571     135.602    -125.298     56.5127   -120.621     
1 1 1 4  7  17 o 0 37.506   0.189158  -8.83951     1.23359      -4.92686     0.994008     134.648    95.9448      64.1792   -164.14      
1 1 1 4  7  18 o 0 12.9503  0.587271  -12.239      -20.914      4.57693      -7.83033     65.3504    -162.565     35.5191   -157.936     
1 1 1 4  7  19 o 0 40.3824  0.286118  -3.68626     -4.81057     2.93721      -3.80845     199.119    170.095      63.6114   171.351      
1 1 1 4  7  20 o 0 11.5239  0.168482  0.103483     0.168255     0.291834     1.741        52.6059    42.3636      15.0475   22.1484      
1 1 1 4  7  21 o 0 10.896   0.843408  1.73895      -6.49324     1.84062      1.46671      47.1256    -117.127     20.9227   -58.2094     
1 1 1 4  8  0  o 0 16.6253  0.140164  -0.0268092   3.28318e-18  0            0            49.671     180          3.40945   -7.82816e-14 
1 1 1 4  8  1  o 0 44.2777  1.32463   34.3353      -10.2944     -7.35078     4.66102      188.169    -30.4779     44.5288   -0.864803    
1 1 1 4  8  2  o 0 36.712   0.651746  -11.6085     9.59653      -1.13401     7.0149       119.185    -159.105     95.541    -52.962      
1 1 1 4  8  3  o 0 64.679   0.264352  0.027965     0.51269      0.607073     -0.389328    266.243    52.757       34.4093   39.5233      
1 1 1 4  8  4  o 0 73.5077  1.26246   20.3199      15.7769      -1.27392     -5.80887     337.973    27.1104      106.462   28.4622      
1 1 1 4  8  5  o 0 41.9195  1.19842   -63.238      8.151        -18.7901     4.74622      187.309    -161.811     57.0814   -153.966     
1 1 1 4  8  6  o 0 14.7102  0.634924  6.90874      59.5559      36.2801      -8.3495      99.4491    52.3626      125.476   78.2299      
1 1 1 4  8  7  o 0 40.9262  1.52492   -84.2124     14.0229      -21.0832     7.04764      137.506    158.618      53.2662   -63.2041     
1 1 1 4  8  8  o 0 28.9477  0.245093  1.31897      -2.93827     1.00115      1.12154      148.389    -129.903     96.5569   -103.317     
1 1 1 4  8  9  o 0 36.047   0.391054  -1.93396     -0.356945    -1.173       -0.341088    164.704    -162.064     58.6866   -157.281     
1 1 1 4  8  10 o 0 64.1857  0.291988  -1.76497     -8.36072     3.79762      -1.23469     260.57     -22.3208     53.5243   -80.7744     
1 1 1 4  8  11 o 0 42.2491  1.80166   -89.146      12.743       -28.3066     8.80128      180.584    -147.809     46.89     -114.4       
1 1 1 4  8  12 o 0 38.95    1.2048    5.51609      39.478       10.5231      -3.29207     166.817    96.8614      42.8188   104.591      
1 1 1 4  8  13 o 0 21.7501  0.957691  -43.307      10.419       -13.9019     7.34054      67.817     -141.977     64.7929   -37.8034     
1 1 1 4  8  14 o 0 11.4892  0.0914361 0.519758     -0.543549    -0.111177    0.638614     46.1728    -85.5033     29.156    -88.9347     
1 1 1 4  8  15 o 0 46.1837  0.676253  12.6031      -1.58982     -4.69938     1.81044      192.489    58.0768      42.58     7.75039      
1 1 1 4  8  16 o 0 58.3091  0.621283  5.76076      13.0126      4.55079      -3.56688     244.047    10.2112      39.6565   23.8547      
1 1 1 4  8  17 f 1 36.6623  1.51523   48.4755      -6.93962     -13.4226     4.45931      130.113    -41.0777     22.0798   106.491      
1 1 1 4  8  18 o 0 17.6502  0.120754  0.293427     0.148042     2.28827      1.78166      71.1074    17.8613      14.1013   51.9513      
1 1 1 4  8  19 o 0 29.1331  0.229373  0.472303     0.179882     -0.494772    0.51718      140.619    -87.5174     44.0594   -91.5883     
1 1 1 4  8  20 o 0 8.90648  0.423511  -2.62877     -0.480375    -1.02873     -0.68083     42.0327    -142.344     31.5424   -149.294     
1 1 1 4  8  21 o 0 29.7263  2.1853    -9.29254     -1.21504     -0.878723    -0.0399083   116.105    -160.549     7.08173   59.3724      
1 1 1 4  9  0  f 1 13.5388  0.113529  -0.0470069   5.75669e-18  0            0            47.2376    180          45.0484   -1.18522e-14 
1 1 1 4  9  1  o 0 50.5851  0.839222  -29.2218     -8.10564     -9.01533     -5.70498     205.94     152.628      26.9506   -169.813     
1 1 1 4  9  2  o 0 35.2283  0.792841  6.45805      -27.0585     6.96593      3.64642      137.266    -55.7838     27.7181   -126.542     
1 1 1 4  9  3  o 0 34.0398  0.188972  -1.56687     2.87559      1.16515      1.60953      147.626    130.222      62.4093   140.419      
1 1 1 4  9  4  o 0 36.8426  0.5808    -2.39882     -17.2749     6.44487      -1.93399     100.607    -83.8578     77.8019   72.8959      
1 1 1 4  9  5  o 0 25.5094  0.739245  40.9625      -7.15603     -16.7352     5.92177      75.5616    -37.6896     95.5984   67.834       
1 1 1 4  9  6  o 0 30.5121  0.417869  5.56796      39.0495      41.4269      -11.3417     141.855    29.1299      120.532   85.6077      
1 1 1 4  9  7  o 0 98.921   0.992741  -6.35903     1.74187      -2.11762     2.27312      357.575    162.273      58.1402   -25.436      
1 1 1 4  9  8  o 0 16.5918  0.481671  4.32219      -13.4257     5.52807      3.86666      83.1339    -115.476     60.7682   -110.387     
1 1 1 4  9  9  o 0 10.0814  0.714926  -12.6532     -12.8751     0.0638284    -3.14363     0.735017   19.7093      75.6522   44.7834      
1 1 1 4  9  10 o 0 32.4092  0.359273  0.283164     1.5761       11.2559      -13.6157     135.125    156.466      28.3211   -166.018     
1 1 1 4  9  11 o 0 31.3089  0.217917  2.20718      0.591193     -18.5649     0.961022     129.898    88.8676      24.4348   115.861      
1 1 1 4  9  12 o 0 32.006   1.57834   -2.63288     111.424      35.9629      1.20756      129.769    136.051      71.1214   -149.402     
1 1 1 4  9  13 o 0 17.8504  0.196525  -7.34842     6.16854      -1.03951     5.22504      78.3329    -158.44      18.4965   -160.515     
1 1 1 4  9  14 o 0 16.9308  0.0995265 1.55765      -1.09698     -0.762133    1.54495      52.3123    42.4156      32.8171   -89.2136     
1 1 1 4  9  15 o 0 49.6434  0.235997  1.44475      -0.18936     -2.48742     -2.00237     177.996    -72.3558     29.3002   85.8985      
1 1 1 4  9  16 o 0 21.7113  1.56784   -16.236      -99.5214     23.4259      -8.16295     73.4497    -101.623     34.833    11.624       
1 1 1 4  9  17 o 0 37.9952  0.420498  11.9424      -2.50396     -4.69519     1.63335      146.637    -74.2936     20.2475   -4.83991     
1 1 1 4  9  18 o 0 19.6285  0.191554  0.454118     -1.15026     6.90356      -1.51951     74.4531    174.634      16.1454   37.3263      
1 1 1 4  9  19 o 0 21.514   0.348707  -0.432077    -0.492128    -0.0430554   -0.145416    85.5482    -108.498     2.34586   69.0573      
1 1 1 4  9  20 o 0 20       0.305304  -0.279402    0.235454     0            0            84.5447    147.625      10.6451   146.042      
1 1 1 4  10 0  o 0 87.9227  0.489743  0.214579     0            0            0            347.177    0            8.58774   180          
1 1 1 4  10 1  o 0 32.728   0.151181  -3.25725     -0.0949754   -18.1255     -3.44872     129.327    97.2014      4.29083   33.1022      
1 1 1 4  10 2  o 0 46.1566  0.203733  0.556923     1.38955      1.57127      -1.03649     175.628    160.391      37.3979   64.6857      
1 1 1 4  10 3  o 0 54.6526  1.0139    -2.33793     -14.1648     2.52036      -0.76684     182.706    -86.6369     64.5896   119.448      
1 1 1 4  10 4  o 0 8.38574  0.527546  1.6788       -14.3444     4.48254      1.09126      31.415     -89.4342     14.6646   -136.397     
1 1 1 4  10 5  o 0 15.034   1.08317   -62.5188     22.4151      -16.4835     13.7183      76.1498    171.759      72.9172   125.29       
1 1 1 4  10 6  o 0 37.8891  0.717499  -4.08316     -19.0469     6.78769      -2.77179     131.207    -149.11      53.3372   -28.5666     
1 1 1 4  10 7  o 0 25.9485  0.172029  -2.8505      -1.50529     -14.8256     -13.4834     74.0299    -69.3335     53.2622   102.935      
1 1 1 4  10 8  o 0 6.46354  0.903412  35.4015      5.86974      -8.84188     -2.99106     24.7129    -48.5113     51.3785   -102.768     
1 1 1 4  10 9  o 0 37.8239  0.390742  1.79835      -7.08225     4.42946      2.06626      146.425    -9.16171     13.2995   -74.7833     
1 1 1 4  10 10 o 0 40.8245  0.743346  13.5125      -14.049      1.23948      11.0937      175.517    -109.483     79.4992   -173.664     
1 1 1 4  10 11 o 0 20.6238  0.372149  26.6585      -3.47274     -36.6586     11.1058      123.279    79.6645      88.4039   96.3286      
1 1 1 4  10 12 o 0 45.5041  0.260741  -1.30438     -3.58938     2.54646      -4.54809     189.92     161.686      21.8642   155.038      
1 1 1 4  10 13 o 0 17.4413  1.17377   -51.7691     -19.0039     -10.4419     -9.05496     63.434     -164.707     7.14962   -25.5543     
1 1 1 4  10 14 o 0 24.6721  0.751693  -21.5157     5.14759      -7.15218     3.92024      107.33     121.48       26.2806   129.662      
1 1 1 4  10 15 o 0 25.7653  0.22303   -5.94593     5.23721      0.159959     8.98302      88.1363    -146.613     24.1109   -1.75088     
1 1 1 4  10 16 o 0 31.6532  0.62978   -5.91563     15.156       4.17288      3.3909       142.525    146.606      46.9927   150.236      
1 1 1 4  10 17 o 0 3.76195  0.80014   16.9508      -0.0396809   -6.22774     -0.0550049   16.6908    -7.43012     10.8166   -20.4593     
1 1 1 4  10 18 f 1 11.5206  0.681896  2.28688      4.14971      0.434744     -0.753611    9.74229    63.5626      72.3447   -115.097     
1 1 1 4  10 19 o 0 4.11096  0.346567  0.100167     -0.07838     0            0            1.90956    32.6765      21.1499   79.6457      
1 1 1 4  11 0  o 0 6.73053  0.0952183 0.0375864    0            0            0            21.1394    0            55.9257   180          
1 1 1 4  11 1  o 0 30.1026  0.197844  3.99692      -1.46731     -1.90285     1.47055      131.784    39.1017      34.1376   50.3083      
1 1 1 4  11 2  o 0 61.3736  1.28891   -22.9092     17.9473      -1.88293     6.29481      236.641    149.679      11.0611   29.6301      
1 1 1 4  11 3  o 0 39.6091  0.600194  -0.0432893   8.7717       2.6339       -0.108228    128.569    74.7155      48.1687   -105.14      
1 1 1 4  11 4  o 0 49.6825  0.764668  -9.05295     -6.90949     -0.808628    -3.45971     177.262    -97.397      34.3823   111.219      
1 1 1 4  11 5  o 0 16.1821  0.602809  17.1905      9.3731       -3.27464     -4.94524     56.9898    42.6654      40.4751   -45.7646     
1 1 1 4  11 6  f 1 12.939   0.445927  0.970867     -24.2381     18.4635      1.68852      33.2363    -12.5433     25.9526   46.1         
1 1 1 4  11 7  o 0 43.0743  1.28432   -14.5812     33.8244      4.16173      4.74602      147.399    101.192      79.8462   -149.515     
1 1 1 4  11 8  o 0 56.7693  0.290471  1.1895       -2.01274     -1.75295     6.81153      223.438    -134.296     98.2498   -45.1929     
1 1 1 4  11 9  o 0 38.2101  1.20781   -12.0902     -47.935      12.752       -7.33506     151.623    -72.7495     12.0649   -162.364     
1 1 1 4  11 10 o 0 41.9938  0.683676  -17.887      -19.1294     0.0573329    -9.63913     180.063    -86.682      27.3321   -90.0818     
1 1 1 4  11 11 o 0 13.9162  0.366635  9.32553      5.65484      -2.58743     -5.27434     20.529     -72.4057     87.7712   179.726      
1 1 1 4  11 12 o 0 20.5788  1.15747   -20.5541     53.9274      13.3186      12.3003      81.9085    83.8684      42.1957   161.08       
1 1 1 4  11 13 o 0 3.86487  0.84743   -4.0126      29.2148      8.63897      2.38789      28.7191    118.301      36.9061   136.869      
1 1 1 4  11 14 o 0 15.3362  0.899494  -31.9392     4.89507      -8.04446     2.40085      52.184     156.744      37.3881   -104.983     
1 1 1 4  11 15 o 0 13.2432  1.15172   28.7553      67.9193      14.8065      -15.5665     57.996     77.8245      22.5558   83.8243      
1 1 1 4  11 16 o 0 32.0053  0.363941  -1.9944      -5.94323     4.70012      -2.02105     130.623    -167.108     18.9069   94.0444      
1 1 1 4  11 17 o 0 11.7653  0.512693  4.45972      0.438801     -1.15411     -0.143093    43.3409    -3.22577     5.76805   147.659      
1 1 1 4  11 18 o 0 18.8494  0.384655  -0.633759    -0.188836    0            0            60.8578    168.186      29.0759   -17.1439     
1 1 1 4  12 0  o 0 14.903   0.119814  -0.0346302   4.24098e-18  0            0            57.8445    0            26.4854   180          
1 1 1 4  12 1  o 0 50.2772  0.350791  -4.21997     -2.6158      -2.88707     -4.41579     228.82     -68.4221     77.834    -96.9332     
1 1 1 4  12 2  o 0 31.8818  0.63074   14.8609      0.160606     -5.57789     0.0634518    140.049    43.5602      37.1338   55.1138      
1 1 1 4  12 3  o 0 11.5662  1.09521   -12.9302     -63.1473     14.8335      -6.43959     42.819     -122.961     44.9016   161.814      
1 1 1 4  12 4  f 1 41.7466  0.240816  -3.41379     0.873579     -4.49714     1.23716      145.99     100.048      64.1855   -11.4692     
1 1 1 4  12 5  o 0 25.5789  0.948809  -26.0068     16.0112      -3.79554     7.10254      113.639    165.347      53.6745   108.723      
1 1 1 4  12 6  o 0 45.8146  0.248373  0.371854     0.192642     -0.115479    -0.173988    192.915    -1.78962     20.072    -5.99612     
1 1 1 4  12 7  o 0 21.9181  0.272995  11.3537      12.2871      0.515545     -17.6282     105.479    132.237      53.5893   175.317      
1 1 1 4  12 8  o 0 34.1864  0.199199  4.52774      -0.420113    -20.1279     -2.6         161.485    -85.3657     56.2059   -110.429     
1 1 1 4  12 9  o 0 2.65041  0.425368  -0.466398    10.9498      5.66668      0.450147     29.21      103.318      48.509    107.914      
1 1 1 4  12 10 o 0 56.3134  0.447355  -12.7009     1.19052      -5.86065     2.51878      237.028    -128.574     30.5      -133.345     
1 1 1 4  12 11 o 0 38.956   0.520503  -10.9394     0.283463     -3.06245     0.381948     171.533    -151.253     40.6451   -152.209     
1 1 1 4  12 12 o 0 21.8515  0.252055  -3.02385     -0.911558    -1.99303     -1.89867     71.3625    -85.647      24.5391   106.526      
1 1 1 4  12 13 f 1 21.2633  1.20831   -24.8849     -41.133      4.20663      -8.31401     86.6614    -121.077     12.6977   -103.399     
1 1 1 4  12 14 f 1 22.9179  1.33866   86.6185      -14.8564     -25.8141     9.59533      76.3492    24.9724      36.5831   141.431      
1 1 1 4  12 15 o 0 22.2508  0.664     -5.61963     10.7693      1.80983      3.15107      86.173     162.157      24.8211   50.3141      
1 1 1 4  12 16 o 0 7.97223  0.806528  14.3828      -4.18034     -3.35132     2.22003      37.1362    -5.66125     24.0843   -55.303      
1 1 1 4  12 17 o 0 20.0823  0.349737  -2.17543     0.00313365   -0.733474    -0.602502    63.111     140.331      35.3192   -36.4105     
1 1 1 4  13 0  o 0 11.8996  0.104131  -0.0583254   7.1428e-18   0            0            38.5447    180          4.90805   -6.96499e-14 
1 1 1 4  13 1  o 0 17.865   0.0953925 2.59679      4.16384      2.52846      -4.44768     110.029    -11.3659     81.8924   -0.754413    
1 1 1 4  13 2  o 0 35.0177  0.944398  -23.1816     7.43415      -5.86397     4.52083      156.513    133.031      33.2032   143.918      
1 1 1 4  13 3  o 0 11.1927  0.857599  -10.8424     62.1282      20.0718      7.36938      9.30399    17.8405      72.254    -96.6881     
1 1 1 4  13 4  o 0 28.6503  0.162364  -0.671535    -0.289191    -5.01495     -0.844176    128.744    -84.8551     49.8553   -34.189      
1 1 1 4  13 5  f 1 19.2237  0.505227  -2.67411     14.0371      4.98271      2.09911      66.9055    124.222      18.9809   -101.672     
1 1 1 4  13 6  o 0 30.0072  0.373363  -1.46926     2.72412      0.669302     1.20767      109.065    71.0049      20.2862   -99.4014     
1 1 1 4  13 7  f 1 6.21702  0.631299  -3.26446     -27.8821     12.011       -2.75566     7.88018    110.027      60.0816   126.001      
1 1 1 4  13 8  o 0 39.9094  0.340593  -6.20894     2.87962      -5.28895     4.18786      160.226    77.6787      46.3348   157.508      
1 1 1 4  13 9  o 0 7.69884  1.43643   -2.4277      -106.119     35.5318      -1.48813     38.6655    -104.83      28.8617   -87.5903     
1 1 1 4  13 10 o 0 29.6191  0.643737  -8.69685     -2.13777     -2.63596     -1.69427     117.08     -135.218     6.81677   -109.172     
1 1 1 4  13 11 o 0 29.8204  0.458966  -4.28345     9.36576      1.86901      1.86087      124.439    156.503      22.7633   127.184      
1 1 1 4  13 12 o 0 20.7525  0.380125  6.48688      -3.22632     -2.77329     3.12804      67.2765    -87.2719     23.5231   105.388      
1 1 1 4  13 13 o 0 24.7474  1.57139   -0.730339    -44.7741     8.82646      -0.604511    107.724    -81.1928     19.4775   -141.048     
1 1 1 4  13 14 o 0 13.0714  0.704834  11.8062      2.38271      -3.98257     -1.90381     77.5691    53.106       54.2428   37.6758      
1 1 1 4  13 15 f 1 27.0023  1.37392   1.32855      -15.0784     4.27268      -0.21983     137.274    -45.3352     54.2203   -52.4503     
1 1 1 4  13 16 o 0 25.6522  0.330665  0.241527     -0.000117335 0.108799     -0.0998915   123.464    38.3919      40.5247   36.0783      
1 1 1 4  14 0  o 0 42.0785  0.283268  -0.042332    5.18418e-18  0            0            172.523    0            17.4524   180          
1 1 1 4  14 1  o 0 20.7405  0.359383  0.258942     -6.98906     1.13188      0.127676     75.9895    -114.996     30.8568   -4.95675     
1 1 1 4  14 2  o 0 8.88565  0.687476  -28.5956     8.22196      -11.1449     7.15247      31.4036    -136.316     14.8345   -50.5358     
1 1 1 4  14 3  o 0 53.3293  0.455553  -4.14249     -8.99795     1.66508      -1.5006      246.731    -123.947     63.4322   -125.198     
1 1 1 4  14 4  o 0 23.3471  0.755003  31.9444      10.4004      -10.4843     -8.07369     72.8254    -35.1797     48.1821   -178.316     
1 1 1 4  14 5  o 0 13.9001  0.10444   1.09923      1.81034      0.402588     -0.857205    62.4947    61.739       57.619    61.676       
1 1 1 4  14 6  o 0 44.649   0.257282  2.03962      -4.34722     1.71613      1.19379      177.3      5.87712      18.9711   -82.0924     
1 1 1 4  14 7  o 0 10.1536  0.574766  -0.826614    12.055       3.29586      0.497169     63.4115    82.5089      74.8933   115.182      
1 1 1 4  14 8  o 0 12.8289  0.107503  4.97782      0.723299     -34.3183     -4.34014     70.4041    80.5742      46.6945   54.9748      
1 1 1 4  14 9  f 1 15.4481  0.118593  -0.873905    -8.91312     6.93078      -1.74667     49.4427    -15.8277     37.4018   98.2942      
1 1 1 4  14 10 o 0 29.5244  0.973061  48.9105      12.4664      -13.8944     -7.04721     102.868    50.6494      53.9629   -57.0511     
1 1 1 4  14 11 o 0 23.6105  0.190033  -0.118486    -0.269868    -0.543109    0.0122852    109.097    71.8478      21.8606   83.7607      
1 1 1 4  14 12 o 0 15.896   0.316079  2.64428      -1.40973     -1.264       1.42285      86.1728    -99.5489     48.1395   -76.2176     
1 1 1 4  14 13 o 0 16.8606  0.869227  4.56777      -12.1715     2.5101       2.43364      86.2377    -67.5324     37.0869   -70.7841     
1 1 1 4  14 14 o 0 31.931   1.64563   -19.2644     -1.0816      -4.89224     0.562155     121.313    -160.149     20.6447   0.479152     
1 1 1 4  14 15 o 0 21.0113  0.893072  0.465432     -3.24387     0.386189     0.218919     82.5304    -71.6863     4.91192   147.51       
1 1 1 4  15 0  o 0 2.62679  0.177886  -0.0070209   8.59812e-19  0            0            2.04768    0            17.2539   180          
1 1 1 4  15 1  o 0 27.8252  0.444049  -12.2377     -9.8116      -0.761759    -4.62935     129.681    -98.3656     43.8739   -128.6       
1 1 1 4  15 2  o 0 10.7488  0.211366  -2.47442     -1.78787     -0.219146    -0.718863    47.9591    175.017      68.9442   -130.087     
1 1 1 4  15 3  o 0 54.559   0.337747  -1.00392     -0.961768    3.7745       1.89292      238.558    -148.839     45.9151   -177.685     
1 1 1 4  15 4  f 1 13.3611  0.11122   3.05255      -3.47626     0.964087     4.51173      46.3494    -120.766     16.379    12.9243      
1 1 1 4  15 5  o 0 30.4453  0.227148  0.747466     -1.10568     -0.552982    3.8431       148.225    -121.933     58.4821   -133.469     
1 1 1 4  15 6  o 0 52.2663  0.310926  0.655974     -1.1647      1.62782      -0.394891    202.373    174.842      8.53801   -26.9986     
1 1 1 4  15 7  o 0 17.4391  0.367566  -5.82403     -14.9592     6.50901      -6.43656     65.1813    -54.5587     23.681    -152.779     
1 1 1 4  15 8  o 0 10.8161  0.12734   1.02615      0.00789837   -3.12022     -0.773801    53.3579    -72.1365     34.0628   -36.2329     
1 1 1 4  15 9  o 0 23.9246  0.71065   -0.962357    12.2897      11.0447      3.56469      109.598    25.6096      20.6106   65.2108      
1 1 1 4  15 10 o 0 33.3     0.254585  -1.83904     2.67873      0.826538     1.1312       170.206    65.1664      60.4927   65.9061      
1 1 1 4  15 11 o 0 14.3626  0.789504  11.2452      -5.68611     -1.43527     2.18103      62.9262    -0.281817    31.2955   -68.9751     
1 1 1 4  15 12 o 0 19.4002  0.824195  -1.90058     -3.99341     0.997918     -0.73318     76.8124    -65.5851     9.65163   172.311      
1 1 1 4  15 13 o 0 29.9288  0.419129  -1.1639      3.83357      2.5832       -0.596422    118.693    150.069      9.825     -64.9175     
1 1 1 4  15 14 o 0 26.4316  1.23121   -4.7646      -2.32896     -0.260106    -0.678673    108.282    -169.98      3.49216   -133.908     
1 1 1 4  16 0  o 0 11.3798  0.207097  0.0581373    0            0            0            46.1037    180          22.5812   -9.75086e-14 
1 1 1 4  16 1  f 1 11.9361  0.4218    9.8153       -0.840201    -6.69035     1.41766      54.224     -80.3261     24.6007   -129.254     
1 1 1 4  16 2  o 0 9.44843  0.908206  23.2476      -11.0678     -3.52032     4.41664      44.0428    -29.477      29.1822   -78.1136     
1 1 1 4  16 3  o 0 45.631   0.305323  -0.603623    -0.37026     -0.319152    -0.0791173   219.879    -161.017     77.3409   -160.062     
1 1 1 4  16 4  o 0 28.1165  0.20333   -0.969873    0.0362073    -2.72074     -5.75313     106.583    127.142      28.5056   23.1992      
1 1 1 4  16 5  o 0 12.0671  0.902     17.9846      1.09464      -5.64272     -0.86541     47.3724    -3.97793     9.10214   -28.534      
1 1 1 4  16 6  o 0 17.689   0.19174   -0.856245    2.13333      2.13985      1.0213       89.8114    -174.976     36.8433   152.398      
1 1 1 4  16 7  f 1 16.5306  0.542468  -9.16951     -0.645905    -2.56413     -0.189377    70.3546    -160.742     4.25929   -132.276     
1 1 1 4  16 8  o 0 40.0626  1.20558   12.5411      -0.888122    -3.58664     -0.16985     182.946    -53.0332     29.152    -23.3564     
1 1 1 4  16 9  o 0 16.9955  0.221832  1.19646      1.50467      -0.0368145   -1.11848     71.8298    -10.2919     3.83677   -47.1124     
1 1 1 4  16 10 f 1 8.07463  0.165938  0.0504445    -0.308999    -0.611564    -1.66578     25.278     129.789      16.0035   -82.9197     
1 1 1 4  16 11 o 0 3.06789  0.594782  -3.60076     -0.116195    -1.41925     -0.201864    33.3439    -176.873     54.6826   -170.509     
1 1 1 4  16 12 o 0 7.94912  0.829893  -2.67297     2.88765      -0.00901354  0.820012     39.2938    127.74       21.8101   130.252      
1 1 1 4  17 0  o 0 45.734   0.523129  0.683929     0            0            0            203.622    180          36.8619   -180         
1 1 1 4  17 1  o 0 19.685   0.263159  0.104696     -0.264157    0            0            91.3558    164.035      13.9827   172.256      
1 1 1 4  17 2  o 0 20.5961  0.381298  0.244219     0.214916     0            0            102.935    97.2707      30.0666   93.1894      
1 1 1 4  17 3  o 0 22.7882  0.318065  0.201451     0.0354352    0            0            111.129    -87.0021     27.4167   -83.9202     
1 1 1 4  17 4  o 0 24.3803  0.359702  -0.577155    -0.0911138   0            0            95.6903    136.731      18.0202   -55.9012     
1 1 1 4  17 5  o 0 24.0744  0.496167  -4.76729     2.11935      -1.31781     1.10294      110.233    84.0182      26.9429   138.743      
1 1 1 4  17 6  o 0 12.1927  0.155134  -0.757647    1.24708      3.31481      0.54141      50.1407    179.285      2.97291   -41.537      
1 1 1 4  17 7  o 0 2.56245  0.293464  0.240681     0.285251     -0.0252547   -0.380161    6.18292    23.7073      12.1209   6.51305      
1 1 1 4  17 8  o 0 5.86129  0.306059  -0.00415169  0.583097     0.103639     -0.0192079   15.2119    34.8885      13.9183   136.689      
1 1 1 4  17 9  f 1 25.9331  0.670234  0.259138     -3.27924     0.818785     0.729047     114.036    -123.28      12.7525   -123.187     
1 1 1 5  0  1  o 0 29.9266  0.205754  -2.30352e-17 -0.125398    0            0            120.296    -90          65.1751   -90          
1 1 1 5  0  2  o 0 13.0882  0.113617  -0.0410155   5.02295e-18  0            0            46.8486    180          40.3579   -0           
1 1 1 5  0  3  o 0 94.2417  0.583693  -2.46077e-16 -1.33958     0            0            410.818    -90          43.7319   90           
1 1 1 5  0  4  o 0 91.259   0.61604   -0.146153    1.78986e-17  0            0            401.241    0            57.8024   4.79134e-14  
1 1 1 5  0  5  o 0 53.8266  0.384597  -5.37012e-17 -0.292336    0            0            229.879    -90          58.5093   -90          
1 1 1 5  0  6  f 1 10.8536  0.122982  -0.00169377  2.07427e-19  0            0            20.5646    -180         22.4506   1.33232e-14  
1 1 1 5  0  7  f 1 109.497  0.727592  1.99164e-16  0.650518     0            0            467.227    90           50.9008   90           
1 1 1 5  0  8  o 0 113.466  0.753791  0.158609     0            0            0            459.202    0            10.9857   180          
1 1 1 5  0  9  o 0 50.2036  0.438355  3.28366e-17  0.107252     0            0            202.048    -90          5.93194   -90          
1 1 1 5  0  10 o 0 92.3082  0.618217  0.219928     0            0            0            368.99     0            8.77425   1.96997e-13  
1 1 1 5  0  11 o 0 109.002  0.784681  -1.28815e-17 -0.0701234   0            0            432.37     -90          25.1293   -90          
1 1 1 5  0  12 o 0 58.3078  0.58073   0.00596167   0            0            0            231.854    0            5.0473    2.51948e-13  
1 1 1 5  0  13 o 0 14.1244  0.14367   -8.21784e-18 -0.0447358   0            0            1.12853    -90          1.98188   -90          
1 1 1 5  0  14 o 0 2.70185  0.283297  -0.00738345  9.04211e-19  0            0            4.08088    0            71.0197   180          
1 1 1 5  0  15 o 0 33.1527  0.229161  -7.1704e-17  -0.390338    0            0            128.067    90           23.8862   90           
1 1 1 5  0  16 o 0 17.1552  0.147372  -0.0887544   1.08693e-17  0            0            68.0504    180          3.11668   -2.20081e-13 
1 1 1 5  0  17 o 0 2.30217  0.28755   2.99102e-18  0.00976941   0            0            1.56295    -90          17.9444   90           
1 1 1 5  0  18 o 0 38.7918  0.26245   -0.0627048   7.67913e-18  0            0            152.419    180          2.86456   -0           
1 1 1 5  0  19 o 0 25.9769  0.191068  1.47673e-16  0.482335     0            0            100.862    90           13.1527   90           
1 1 1 5  0  20 o 0 5.04975  0.181487  0.0344976    0            0            0            16.7507    0            25.0429   180          
1 1 1 5  0  21 o 0 23.0738  0.189136  8.43393e-17  0.275473     0            0            96.668     90           17.6544   -90          
1 1 1 5  1  0  o 0 25.2705  0.208011  3.22943e-18  0.0105481    0            0            103.255    -90          1.88537   -90          
1 1 1 5  1  1  o 0 11.7426  0.73049   12.5801      37.2823      11.157       -8.58735     28.5998    -89.7484     142.466   -83.2071     
1 1 1 5  1  2  o 0 35.0878  0.943971  2.50409      75.5091      85.5327      -8.02764     167.07     146.474      109.204   84.8178      
1 1 1 5  1  3  f 1 45.7409  0.226305  -1.86388     0.95575      -2.6354      2.00042      209.406    -117.139     34.3421   -140.503     
1 1 1 5  1  4  f 1 42.3453  1.89175   -2.45391     90.0975      28.0886      1.24714      176.02     124.487      22.2375   0.177556     
1 1 1 5  1  5  o 0 38.5222  0.587114  -4.11611     10.6622      2.12246      2.00024      227.384    152.818      168.873   124.353      
1 1 1 5  1  6  o 0 39.209   1.10385   -4.19854     -8.48573     0.909765     -1.22688     121.842    -107.378     85.5165   94.7528      
1 1 1 5  1  7  o 0 53.8857  0.273245  -0.191602    -0.531904    0.268583     -1.54821     228.775    -38.4574     18.619    -101.083     
1 1 1 5  1  8  f 1 53.0027  1.62009   -4.60455     -35.8256     9.41927      -2.6623      246.279    -67.2052     95.1577   -104.746     
1 1 1 5  1  9  o 0 65.5527  0.396304  3.69917      -1.43        -1.22801     0.919616     247.787    -69.8387     23.2695   106.357      
1 1 1 5  1  10 o 0 6.09273  0.240117  0.392108     -9.64613     9.27987      0.678213     21.7811    91.4538      57.2926   95.3512      
1 1 1 5  1  11 o 0 46.9935  1.03688   -10.1763     16.3985      2.12722      4.02246      166.275    148.652      79.8459   40.3776      
1 1 1 5  1  12 o 0 27.7843  0.369221  3.24862      9.8524       7.6637       -6.12832     91.0009    130.635      68.2099   17.9142      
1 1 1 5  1  13 o 0 50.4744  0.330462  0.459073     0.395767     -0.203668    -0.491067    197.224    20.0575      4.02586   -16.3886     
1 1 1 5  1  14 o 0 21.2066  0.126552  -2.34121     -8.76579     15.0836      -7.72044     103.071    -21.8534     42.4055   -23.6977     
1 1 1 5  1  15 o 0 41.2135  0.500255  9.89525      -4.75807     -3.74937     5.84672      155.621    38.317       24.1099   -56.8917     
1 1 1 5  1  16 o 0 24.4295  0.212105  1.2157       -4.82433     1.84241      1.05124      96.0488    -81.2824     12.7555   -100.068     
1 1 1 5  1  17 o 0 41.0759  0.880933  -13.2256     15.335       0.391743     3.47359      145.726    115.475      34.0093   -87.4007     
1 1 1 5  1  18 f 1 24.0355  0.125707  2.94499      6.94928      7.71409      -6.91193     126.754    -10.0727     67.1139   -9.17512     
1 1 1 5  1  19 o 0 32.7034  0.328456  5.96287      2.47514      -0.911507    -1.09011     127.815    -26.1711     19.7582   44.7431      
1 1 1 5  1  20 f 1 3.4518   0.510041  -1.92475     -20.9845     13.8071      -2.71029     9.29416    -91.8023     13.4975   -146.635     
1 1 1 5  1  21 o 0 23.1348  0.298269  -3.91952     2.30437      -1.01692     2.99721      92.2172    -150.758     11.3656   -30.9521     
1 1 1 5  1  22 o 0 7.53025  0.549564  0.904269     -2.25952     0.4912       0.346047     29.3487    -85.117      9.72704   -32.3407     
1 1 1 5  2  0  o 0 24.1495  0.195108  3.44614e-17  0.112559     0            0            55.967     90           35.3502   90           
1 1 1 5  2  1  o 0 51.4228  0.261365  -0.362948    0.557736     -9.85939     5.69164      226.94     71.263       78.8443   7.62338      
1 1 1 5  2  2  o 0 33.2133  0.960978  26.5987      -16.0796     -4.50438     9.12859      173.722    2.87908      76.5618   -1.8076      
1 1 1 5  2  3  o 0 43.8112  0.245018  -8.41322     1.06243      -39.7986     1.02197      180.017    108.493      115.357   -163.872     
1 1 1 5  2  4  o 0 12.6316  0.508724  -28.4935     -10.7049     -14.4692     -12.4903     27.2711    142.137      39.1011   -48.2515     
1 1 1 5  2  5  o 0 52.4813  0.618144  3.98335      1.92077      -1.56111     -1.58427     230.148    66.9682      38.3466   106.447      
1 1 1 5  2  6  o 0 4.59372  1.51544   -35.4114     3.63956      -3.49467     0.732238     40.2125    143.755      51.7752   121.731      
1 1 1 5  2  7  o 0 42.1307  1.1372    28.7475      -11.6093     -6.59109     6.07754      191.329    -47.5208     37.502    -38.0448     
1 1 1 5  2  8  o 0 67.0123  0.305263  0.0094484    -2.92476     1.01058      0.118562     269.297    -43.7544     9.78847   -56.494      
1 1 1 5  2  9  f 1 80.9488  0.340035  -1.30901     0.0413083    -2.20775     1.13666      283.272    -104.271     75.6558   90.0176      
1 1 1 5  2  10 o 0 46.467   1.12412   29.8351      14.2093      -5.76584     -6.8954      178.606    42.805       2.91078   -97.6709     
1 1 1 5  2  11 o 0 24.1284  0.135104  0.295682     -0.860959    2.31526      1.29443      101.629    -0.945891    78.5282   -66.1165     
1 1 1 5  2  12 o 0 53.9133  0.619206  6.86598      -0.284684    -4.63309     0.634498     227.512    63.9402      35.3854   63.0582      
1 1 1 5  2  13 o 0 30.3293  1.17842   -30.2336     25.1229      -1.51114     7.6888       140.927    146.329      71.5471   105.717      
1 1 1 5  2  14 o 0 48.8615  0.295057  1.02109      5.45591      1.31358      -0.41862     154.98     29.3871      68.1774   -170.859     
1 1 1 5  2  15 o 0 25.4168  0.964484  -41.2775     7.42865      -9.80035     3.42855      41.0759    163.818      119.77    22.9702      
1 1 1 5  2  16 o 0 11.6894  1.12853   -74.3229     -28.8883     -18.0049     -16.2927     35.7461    -160.996     39.812    100.673      
1 1 1 5  2  17 f 1 14.7113  0.101738  -0.253481    0.328989     2.05706      1.95513      53.1262    -160.478     6.50694   22.3735      
1 1 1 5  2  18 o 0 5.97109  0.457306  -14.846      -0.280898    -6.46751     -0.181673    34.0055    2.84606      103.559   11.6227      
1 1 1 5  2  19 o 0 14.2604  1.187     -80.3882     32.7209      -20.1951     20.0937      94.2664    -172.953     85.9937   177.679      
1 1 1 5  2  20 o 0 28.3384  0.426644  -9.20379     -8.31243     -0.136028    -3.68872     120.207    -93.6618     29.3446   -113.582     
1 1 1 5  2  21 f 1 22.1557  0.319135  7.46874      -0.325562    -6.90871     -0.33714     121.629    73.453       63.2312   84.6174      
1 1 1 5  2  22 o 0 5.78958  0.641875  4.36733      1.44508      -1.38783     -0.881332    3.03158    -6.43671     40.3177   -118.899     
1 1 1 5  2  23 o 0 4.1104   0.943469  -1.42123     2.79489      0.275814     0.416707     6.29552    138.691      17.9498   -89.5565     
1 1 1 5  3  0  o 0 8.66603  0.108263  -2.5769e-18  -0.014028    0            0            6.93408    -90          13.0609   90           
1 1 1 5  3  1  o 0 18.7917  2.14101   -30.0919     -243.671     63.3146      -16.0905     73.9132    -99.0637     20.5686   171.663      
1 1 1 5  3  2  o 0 34.7137  1.80193   -19.5457     -104.19      27.5084      -11.0268     91.1603    -80.7868     103.042   83.4659      
1 1 1 5  3  3  o 0 35.8577  0.195858  0.304853     -0.846821    0.409867     3.35011      153.779    -135.407     49.7437   162.105      
1 1 1 5  3  4  o 0 35.3653  0.492111  1.63693      -6.97978     6.27495      2.72227      143.763    -6.15755     18.8116   -98.6311     
1 1 1 5  3  5  o 0 30.442   1.73203   -1.8851      -61.9141     16.2444      -0.888028    138.703    -91.5129     37.3544   -106.903     
1 1 1 5  3  6  o 0 39.8525  0.376238  -5.11539     -1.84454     -1.84728     -1.7211      218.013    139.732      117.657   153.877      
1 1 1 5  3  7  f 1 20.9199  1.30187   -14.6882     -41.0577     8.92799      -7.22649     75.066     -111.995     9.49746   123.04       
1 1 1 5  3  8  o 0 51.4258  0.679178  -6.12077     -9.8443      1.29474      -2.43935     192.121    -163.771     80.4195   -66.4393     
1 1 1 5  3  9  o 0 70.3727  0.645335  3.24179      -5.18235     0.85682      1.63053      248.821    -29.7609     53.4668   147.921      
1 1 1 5  3  10 o 0 27.9304  0.187213  2.15668      -2.17166     -0.0334538   1.22402      133.375    -39.1519     86.0052   -39.903      
1 1 1 5  3  11 o 0 113.126  0.677502  1.86914      15.8732      6.9808       -0.473159    538.166    25.5754      187.006   31.0736      
1 1 1 5  3  12 o 0 30.0339  0.566943  17.8506      6.06622      -4.21658     -3.38019     99.1362    -10.7647     39.7639   131.021      
1 1 1 5  3  13 f 1 23.1274  0.298046  -2.07902     -3.96877     1.63724      -2.51103     72.4227    -51.125      43.4231   75.1987      
1 1 1 5  3  14 o 0 22.5523  0.497962  -8.5201      -7.41782     -0.841717    -5.08089     120.184    -87.0633     73.6036   -96.4623     
1 1 1 5  3  15 o 0 3.18822  0.39507   3.29859      -15.447      9.21166      4.191        21.2401    138.676      52.9427   134.548      
1 1 1 5  3  16 o 0 23.8814  0.283518  -5.33768     5.78079      0.107966     2.618        83.4522    92.1725      44.4656   -161.877     
1 1 1 5  3  17 o 0 56.3018  0.467932  -0.9803      11.7245      8.94525      0.165357     217.988    157.96       13.3824   -92.7745     
1 1 1 5  3  18 o 0 41.7872  0.771022  18.4295      11.6014      -2.47056     -4.54582     171.321    58.6492      22.627    36.5193      
1 1 1 5  3  19 o 0 17.5053  0.457047  3.25955      11.2784      2.4948       -1.7273      75.3996    111.65       37.5299   59.4         
1 1 1 5  3  20 o 0 10.1358  0.333578  -2.3822      -7.98069     6.84042      -3.82992     46.4802    173.279      18.1836   119.675      
1 1 1 5  3  21 o 0 10.4609  0.192358  0.0482751    2.9417       6.54316      1.08426      38.8713    171.107      13.9849   53.6942      
1 1 1 5  3  22 o 0 9.46698  0.13814   -0.765063    0.625083     0.190188     0.71575      40.2951    -172.15      11.0427   -151.255     
1 1 1 5  4  0  o 0 21.1542  0.192063  -3.17655e-17 -0.172923    0            0            83.8011    -90          34.7889   90           
1 1 1 5  4  1  o 0 40.7672  1.40167   -15.3634     14.2108      -0.225649    3.92457      145.953    130.069      56.1963   -113.729     
1 1 1 5  4  2  o 0 29.2221  1.31009   -33.5567     6.05096      -9.53064     3.71372      69.4738    151.86       87.9149   -32.3959     
1 1 1 5  4  3  o 0 59.8568  0.995072  16.0319      1.20332      -3.07653     -0.565484    264.458    -6.92555     47.7395   6.80513      
1 1 1 5  4  4  o 0 13.5099  0.119713  -5.24324     0.0657351    -13.5357     -0.118736    42.2067    149.092      90.6864   -134.012     
1 1 1 5  4  5  o 0 31.877   0.247439  0.99041      3.93202      2.01142      -0.980162    111.531    28.9943      50.0827   -89.4273     
1 1 1 5  4  6  o 0 91.3193  0.399861  -4.78895     2.09317      -12.8675     4.43952      360.868    86.064       11.7441   9.39012      
1 1 1 5  4  7  o 0 46.7917  0.763012  -0.768917    8.31009      1.83509      0.408506     141.612    70.9804      82.0696   -124.863     
1 1 1 5  4  8  o 0 68.9263  0.322562  -0.523168    0.684193     0.0838979    0.328626     268.614    93.0218      1.67696   1.86303      
1 1 1 5  4  9  o 0 39.2394  0.19271   0.327263     0.0225177    -0.0932982   -0.013632    153.905    -89.9152     14.287    -56.0457     
1 1 1 5  4  10 o 0 23.5367  0.353956  -23.3585     3.15934      -25.0321     7.24428      120.877    -129.781     92.8426   -171.445     
1 1 1 5  4  11 f 1 22.6111  0.463757  0.824931     -19.1066     6.90775      0.668303     12.9159    -121.936     146.691   49.5619      
1 1 1 5  4  12 o 0 75.9612  1.32077   -20.933      3.9474       -5.98336     2.80908      337.725    145.141      86.6545   143.734      
1 1 1 5  4  13 o 0 7.73231  0.807808  -6.12943     -25.3546     4.90172      -2.49872     68.778     -132.424     100.361   -152.947     
1 1 1 5  4  14 o 0 8.41187  0.089154  0.0539627    0.00419326   -0.0064229   -0.0341291   24.3751    7.53561      98.184    6.45344      
1 1 1 5  4  15 o 0 7.3853   0.0918705 0.0465111    0.0426457    -0.00120689  -0.00469271  4.22462    -5.56589     24.3408   -25.5783     
1 1 1 5  4  16 o 0 36.6918  0.666259  -34.2301     4.89928      -24.8912     5.74933      145.981    102.589      7.62516   38.1993      
1 1 1 5  4  17 o 0 21.3023  0.885775  5.94334      18.4197      3.30827      -2.28266     65.4663    57.4673      49.2548   -179.207     
1 1 1 5  4  18 o 0 17.4285  0.584047  38.6211      -3.57872     -19.0863     3.9863       88.3308    54.1835      43.2041   56.2617      
1 1 1 5  4  19 o 0 5.11066  0.639262  -10.0487     15.3947      1.9481       4.51281      10.2601    7.60633      50.0934   -27.8049     
1 1 1 5  4  20 o 0 5.71186  0.354037  3.90306      -1.02832     -1.41183     0.704991     14.085     -20.5262     7.92457   -174.115     
1 1 1 5  4  21 o 0 33.9464  1.22987   14.7332      3.61959      -1.77232     -0.743836    157.357    13.2409      37.4404   15.4357      
1 1 1 5  4  22 o 0 18.0529  1.38056   13.151       -2.982       -3.93562     1.28327      89.2927    -19.3834     37.9863   -28.2049     
1 1 1 5  5  0  o 0 20.9619  0.149207  1.02719e-17  0.0335506    0            0            83.2682    -90          39.196    90           
1 1 1 5  5  1  o 0 40.5947  2.52212   2.67792      117.572      30.1934      -1.64563     203.972    86.1378      93.4906   98.8293      
1 1 1 5  5  2  o 0 23.4088  0.250503  1.43628      0.301034     -0.634605    -0.239279    89.1514    -48.9292     25.913    26.735       
1 1 1 5  5  3  o 0 22.8835  0.232745  0.727049     2.13296      0.719997     -0.468593    114.627    38.9187      80.9404   45.8898      
1 1 1 5  5  4  o 0 21.3832  0.141203  1.80684      -0.369717    -1.66439     0.584784     96.3456    -70.3618     59.7289   -81.8337     
1 1 1 5  5  5  o 0 59.1726  2.02066   -11.1155     -59.9432     14.7895      -5.95453     269.906    -76.4717     92.541    -103.539     
1 1 1 5  5  6  o 0 102.094  0.439231  -0.977832    -0.423025    -1.33435     0.0114951    369.262    -78.8657     63.4289   120.455      
1 1 1 5  5  7  o 0 45.8636  0.94042   -3.32071     -26.1313     9.83454      -2.80861     151.717    -55.949      104.885   -168.434     
1 1 1 5  5  8  f 1 36.2787  0.554984  2.21843      -10.6925     3.4543       1.57219      169.248    -91.0524     76.4205   -96.0331     
1 1 1 5  5  9  o 0 70.072   0.326883  -1.40923     -2.46223     0.673444     -0.994993    273.302    18.4261      50.6365   -61.7876     
1 1 1 5  5  10 o 0 51.3141  0.25045   -3.43065     -3.82989     1.08638      -4.74787     278.363    152.828      167.591   167.679      
1 1 1 5  5  11 o 0 43.0256  0.948879  7.5376       32.9052      19.047       -10.3165     196.898    145.291      67.6795   171.178      
1 1 1 5  5  12 o 0 28.5462  0.152048  -2.48412     2.38692      -1.16928     6.43918      92.3658    62.1327      42.6522   -159.234     
1 1 1 5  5  13 o 0 30.4082  0.178034  -0.0204727   1.14712      3.79383      -0.689438    125.869    0.167072     33.059    -44.5056     
1 1 1 5  5  14 o 0 45.1034  0.473999  2.15421      -6.56529     3.42734      1.90293      208.592    -39.4357     71.7319   -13.3468     
1 1 1 5  5  15 o 0 11.8851  0.278245  7.95705      18.7782      12.7682      -12.7084     41.625     162.404      39.1841   -136.17      
1 1 1 5  5  16 f 1 7.87011  0.373219  7.20804      -1.0195      -2.17257     0.58652      29.948     -7.10676     32.3106   -70.9645     
1 1 1 5  5  17 o 0 24.2119  1.55181   17.1123      88.9849      24.1019      -9.30569     118.793    54.6933      62.0635   84.1259      
1 1 1 5  5  18 o 0 29.2726  0.603288  6.13663      -3.50391     -1.72887     2.52261      85.9609    -14.0801     49.3039   157.926      
1 1 1 5  5  19 o 0 14.2488  0.654622  6.10612      -25.149      5.43935      2.68362      59.1819    -63.9754     31.2349   -121.457     
1 1 1 5  5  20 f 1 25.9779  0.156295  -0.10133     -0.0401844   0.000186108  -0.00963823  131.026    -11.5336     51.5795   -11.9987     
1 1 1 5  5  21 o 0 5.33807  0.351928  -1.11349     -2.42727     1.99751      -1.53082     9.91774    -97.5541     5.68578   -158.455     
1 1 1 5  5  22 o 0 9.64723  0.495934  1.4849       -1.17757     -0.0279042   0.392521     20.5445    -85.4548     40.2556   44.7817      
1 1 1 5  6  0  o 0 48.0125  0.292922  8.04179e-17  0.262665     0            0            193.221    90           43.2505   90           
1 1 1 5  6  1  o 0 87.6353  0.815087  1.18928      7.08917      0.955123     -0.2625      344.694    90.2243      16.4567   -61.1929     
1 1 1 5  6  2  o 0 19.7447  0.967125  -30.4096     -7.93157     -8.61951     -4.92202     23.3573    -178.804     91.0197   14.7143      
1 1 1 5  6  3  o 0 24.4468  0.544231  11.006       -3.63342     -3.07561     2.19012      107.253    9.44941      52.1618   -30.4762     
1 1 1 5  6  4  o 0 41.4333  0.235838  5.46324      -2.20322     -6.75282     5.50105      184.9      -95.0755     74.4123   -51.7666     
1 1 1 5  6  5  f 1 106.591  0.427138  -1.33861     1.05374      0.660895     1.60997      431.075    -143.921     37.101    -170.62      
1 1 1 5  6  6  f 1 8.8282   0.830041  97.6399      -14.6814     -56.5138     17.269       33.7503    177.707      99.5168   -174.242     
1 1 1 5  6  7  f 1 113.824  1.63026   -13.2899     -3.49809     -1.84603     -1.40696     503.989    -141.439     124.604   -150.215     
1 1 1 5  6  8  o 0 35.8479  0.174115  1.63852      1.13513      -0.700993    -2.26477     154.973    107.519      54.0539   146.28       
1 1 1 5  6  9  o 0 28.0783  1.349     74.586       -23.6396     -16.7704     11.9101      102.509    -13.9936     21.1276   -118.513     
1 1 1 5  6  10 o 0 15.2053  1.02151   -43.898      27.0001      -6.75171     13.1721      47.1834    138.923      28.5404   29.8271      
1 1 1 5  6  11 o 0 41.9141  0.209669  -0.520542    3.77226      2.67032      1.1296       208.92     -173.559     106.409   166.613      
1 1 1 5  6  12 o 0 32.9121  0.303237  3.26411      -0.0984285   -9.3973      2.21097      158.581    -93.2931     69.3319   -108.516     
1 1 1 5  6  13 o 0 15.8008  1.02074   -57.0229     -10.022      -16.6124     -5.9193      40.9407    -152.068     31.344    41.0796      
1 1 1 5  6  14 o 0 9.43588  0.293886  0.412706     6.76942      2.76195      -0.382747    48.289     90.1025      47.5621   86.4054      
1 1 1 5  6  15 o 0 18.3658  0.629897  38.5834      -11.5657     -13.43       8.511        67.511     -54.9784     36.3505   40.9154      
1 1 1 5  6  16 o 0 27.3116  0.257357  17.11        -6.57573     -14.0558     10.9894      103.065    -88.8848     29.2044   8.58417      
1 1 1 5  6  17 f 1 20.7945  0.121626  -1.00567     -0.610882    -0.388375    -2.85704     55.8138    -56.6421     60.181    172.789      
1 1 1 5  6  18 o 0 18.7905  0.400468  -31.0541     -0.231053    -18.0237     0.227985     83.3573    -126.061     45.3517   -176.719     
1 1 1 5  6  19 f 1 31.8782  0.674773  15.9665      1.71653      -2.79353     -0.364254    153.032    24.4502      44.1509   14.023       
1 1 1 5  6  20 o 0 5.78463  0.767442  -3.367       6.50305      0.746455     1.11108      29.9749    124.499      23.5664   156.906      
1 1 1 5  6  21 o 0 17.6927  0.166314  0.178116     -0.626999    0.0980356    0.00528834   79.0619    -144.783     18.953    -136.074     
1 1 1 5  7  0  o 0 2.88097  0.179385  -6.67433e-19 -0.00363334  0            0            1.1419     90           31.75     -90          
1 1 1 5  7  1  o 0 77.1639  1.38352   4.61368      -25.4565     8.59498      2.74366      303.435    -36.3423     15.5763   -44.0695     
1 1 1 5  7  2  o 0 42.6225  1.25855   -2.25935     27.1368      7.77088      1.10061      196.307    68.0985      75.3633   85.413       
1 1 1 5  7  3  o 0 55.5566  0.447452  4.3057       0.397825     -2.03416     -0.195135    233.801    -23.2871     48.0002   -39.2265     
1 1 1 5  7  4  o 0 46.2081  0.746979  11.2738      21.0704      5.50378      -8.47826     159.726    104.136      93.8072   -155.286     
1 1 1 5  7  5  o 0 39.1657  1.44264   23.9751      75.4927      16.2567      -11.6781     133.337    76.0293      30.3658   -103.514     
1 1 1 5  7  6  o 0 30.8465  0.640529  -11.318      3.4797       -1.9012      1.26463      112.925    157.061      21.5979   -104.22      
1 1 1 5  7  7  o 0 91.5246  0.731797  -3.21023     8.06562      3.00139      2.24069      410.31     70.4814      107.971   64.0047      
1 1 1 5  7  8  o 0 83.0051  1.48856   -4.58497     -37.6349     11.4535      -3.25854     358.684    -54.6609     80.6777   -81.197      
1 1 1 5  7  9  o 0 27.5032  0.614063  -13.8583     -4.08781     -3.52227     -2.17785     91.8556    -149.097     22.9819   24.1857      
1 1 1 5  7  10 o 0 33.2974  0.650939  -9.22665     -25.5372     14.6836      -13.2509     120.754    -37.2596     27.8573   83.3147      
1 1 1 5  7  11 o 0 12.1884  0.337212  -3.38557     -8.78421     5.57018      -5.21558     31.853     -131.207     75.3831   -48.5657     
1 1 1 5  7  12 o 0 12.7107  0.488561  6.26291      -30.3091     13.0993      5.88856      94.3422    -62.7564     139.311   -91.7462     
1 1 1 5  7  13 o 0 6.93258  0.598145  -12.9681     16.8319      1.25351      4.84555      47.3101    127.039      44.5162   126.789      
1 1 1 5  7  14 f 1 9.99639  1.64961   25.6047      167.639      45.0372      -14.2185     49.9975    33.287       100.747   -11.0912     
1 1 1 5  7  15 o 0 9.72386  0.0939749 -2.38342     -1.65713     -1.70306     -6.14723     36.0521    135.967      3.45316   -93.7063     
1 1 1 5  7  16 o 0 24.5585  0.358127  -5.12409     -6.83295     0.713337     -2.22187     105.367    -130.423     26.466    -132.467     
1 1 1 5  7  17 o 0 28.7295  1.06739   -4.79098     -45.6502     11.6186      -2.14846     103.805    -120.543     53.3424   -26.4159     
1 1 1 5  7  18 o 0 41.6165  0.796224  -0.236078    -16.2521     3.88204      -0.281692    154.433    -68.5153     4.9461    140.435      
1 1 1 5  7  19 o 0 25.7405  0.17358   -2.46747     2.77963      0.721343     2.00576      106.504    -143.201     36.804    136.331      
1 1 1 5  7  20 o 0 12.2119  0.830418  1.93442      5.47725      1.63072      -0.852789    30.5341    78.1549      34.9519   -88.6908     
1 1 1 5  7  21 o 0 7.8491   0.779976  2.49341      3.98584      0.649282     -1.04104     16.5647    42.5535      28.3523   -170.488     
1 1 1 5  8  0  o 0 77.0396  0.443958  -6.85271e-17 -0.373044    0            0            297.302    -90          34.7491   -90          
1 1 1 5  8  1  o 0 42.9904  0.371703  7.39349      1.12809      -3.83752     -1.14265     175.685    70.6463      40.0469   21.6393      
1 1 1 5  8  2  o 0 75.9534  0.308945  -2.80376     -4.13057     1.03802      -4.42084     309.953    -50.1039     42.1682   -80.3673     
1 1 1 5  8  3  o 0 27.6535  1.80591   160.883      -20.183      -41.1194     10.6306      58.1894    -13.2862     105.166   -154.225     
1 1 1 5  8  4  o 0 53.1802  0.960093  -13.4967     16.7846      0.935793     4.72421      205.073    97.3327      108.828   178.419      
1 1 1 5  8  5  o 0 47.8133  0.816089  22.5945      -7.19507     -6.25455     4.68393      152.644    -12.939      56.2153   153.361      
1 1 1 5  8  6  o 0 21.7535  0.6304    22.4335      3.08919      -6.06107     -1.67464     65.9582    13.1258      39.1516   -114.625     
1 1 1 5  8  7  o 0 17.6858  1.67626   -153.513     14.6646      -34.5857     6.74984      31.4264    -142.446     101.29    -33.5038     
1 1 1 5  8  8  f 1 70.6098  0.79251   3.43352      8.54327      1.63419      -1.96576     299.827    131.042      63.0713   100.177      
1 1 1 5  8  9  o 0 20.2884  1.72269   -136.551     30.249       -39.8149     18.7615      70.2145    -169.137     37.9368   83.9071      
1 1 1 5  8  10 o 0 25.9112  0.133802  -0.13875     0.00239756   2.51568      1.1904       83.3137    -165.715     52.7158   -50.4837     
1 1 1 5  8  11 o 0 5.52496  0.360873  -7.11621     3.21511      -1.49948     1.72417      52.3148    170.999      77.3959   -177.545     
1 1 1 5  8  12 o 0 20.0569  0.349721  5.06154      7.14357      0.7247       -1.87477     56.0881    41.0199      53.8086   172.563      
1 1 1 5  8  13 f 1 33.2776  0.599824  -55.9111     8.28867      -26.3223     7.37544      149.855    122.048      66.1424   172.151      
1 1 1 5  8  14 o 0 23.3824  0.550736  -0.619463    15.7576      3.7596       0.405847     86.0116    78.1689      8.31767   -134.358     
1 1 1 5  8  15 o 0 19.8296  1.68938   110.351      -16.3662     -29.006      9.15926      41.3198    7.7037       68.432    174.557      
1 1 1 5  8  16 o 0 17.6736  0.446192  6.73473      -3.81321     -0.861104    1.50571      53.4141    -22.7968     23.9004   163.455      
1 1 1 5  8  17 o 0 22.1499  0.541606  -7.4184      0.753194     -1.1883      0.304212     91.9359    -148.998     27.2383   168.016      
1 1 1 5  8  18 o 0 22.4242  0.150008  -1.43728     -0.299126    -1.49142     -1.86187     94.416     132.469      15.7934   65.7029      
1 1 1 5  8  19 o 0 21.3875  1.70876   -35.0033     6.45916      -6.76687     2.94963      108.327    179.44       44.3202   173.267      
1 1 1 5  8  20 o 0 3.6867   0.265541  -0.0398453   0.131026     0.247316     -0.125526    1.63111    116.873      3.19267   -8.72779     
1 1 1 5  9  0  o 0 4.23084  0.137288  -1.81822e-19 -0.000989792 0            0            0.983176   90           11.8829   -90          
1 1 1 5  9  1  o 0 16.2369  0.457962  12.2451      -15.4552     1.82033      7.904        67.4585    -81.0371     35.1846   -48.0196     
1 1 1 5  9  2  o 0 22.8972  0.212833  -2.39625     -18.5296     39.9055      -11.5468     74.8864    162.474      54.799    49.1743      
1 1 1 5  9  3  o 0 62.8122  1.08126   19.3784      -5.83819     -3.71577     2.29517      245.107    -49.9156     71.6905   32.9424      
1 1 1 5  9  4  o 0 54.3043  1.66621   4.55938      74.8059      17.2421      -1.93828     240.92     90.8293      67.7312   72.6365      
1 1 1 5  9  5  o 0 20.2381  0.433472  6.41302      6.9224       0.166889     -1.84614     18.5119    64.9609      116.795   -147.599     
1 1 1 5  9  6  o 0 77.4412  0.323191  -1.42032     -0.332661    -0.218004    -0.193211    333.233    19.5304      66.4206   20.1818      
1 1 1 5  9  7  o 0 54.5342  0.379816  3.01233      0.44414      -2.18574     -0.185584    195.827    71.9104      28.4931   -109.97      
1 1 1 5  9  8  o 0 50.2184  1.22078   7.60207      51.6832      24.5979      -8.23055     215.458    19.8353      58.8983   -18.8318     
1 1 1 5  9  9  o 0 42.5104  0.39707   2.6401       -0.248957    -2.94896     1.04519      118.592    64.6593      88.398    -128.923     
1 1 1 5  9  10 o 0 38.8884  1.32766   -6.53076     -95.585      26.2189      -3.05262     143.711    -112.684     88.6227   -26.2202     
1 1 1 5  9  11 o 0 21.2931  0.615715  -2.24941     -17.8995     5.71733      -1.65886     81.3117    -66.5285     39.4807   -153.799     
1 1 1 5  9  12 o 0 25.1871  0.340563  -2.58094     -10.8928     8.55598      -5.0121      94.5397    -24.1589     37.4008   73.1941      
1 1 1 5  9  13 o 0 25.2201  0.697595  -12.0466     -3.36972     -3.31357     -1.8557      88.6077    -151.951     16.9588   10.3199      
1 1 1 5  9  14 o 0 27.3956  0.193421  3.7751       22.9147      33.1632      -8.54276     84.8077    -1.024       45.2114   -160.903     
1 1 1 5  9  15 o 0 21.8447  0.407113  6.12091      -3.49911     -0.930762    1.40358      88.8003    -5.77869     16.9395   -34.7846     
1 1 1 5  9  16 o 0 8.33347  0.435119  2.14689      -14.734      6.54828      1.86091      37.5254    -48.7681     32.8929   -102.367     
1 1 1 5  9  17 o 0 20.4495  0.256467  1.32642      -0.333115    -0.314097    0.307988     104.297    -95.6999     44.3714   -86.8521     
1 1 1 5  9  18 o 0 4.9994   0.760208  3.66744      12.8387      3.8268       -2.45729     2.74374    75.8835      28.3181   -99.1846     
1 1 1 5  9  19 f 1 16.5602  0.385877  0.96114      -0.0548277   -0.262669    0.197455     73.0057    64.7109      16.4774   44.946       
1 1 1 5  9  20 o 0 16.288   0.277643  -0.974723    -0.102974    0            0            58.1519    164.637      11.408    -31.5913     
1 1 1 5  10 0  o 0 32.8009  0.218052  2.99697e-17  0.0978886    0            0            128.263    -90          16.39     90           
1 1 1 5  10 1  f 1 84.7095  0.350304  0.159288     -0.903376    -1.52842     3.01502      350.436    -135.051     47.4706   -106.292     
1 1 1 5  10 2  o 0 35.4093  0.158442  0.0965775    -1.78729     3.11931      1.08594      140.642    1.01979      9.25585   14.352       
1 1 1 5  10 3  o 0 50.362   1.30064   54.7926      -2.02233     -19.9996     0.910644     178.927    43.6609      33.2574   -129.255     
1 1 1 5  10 4  o 0 60.7288  0.350221  -1.60107     -2.34211     0.638745     -1.08257     211.215    174.747      47.9965   -12.5716     
1 1 1 5  10 5  o 0 28.7228  0.134912  -1.76207     -0.942479    -7.47985     -6.76643     85.2147    -92.9614     107.039   163.503      
1 1 1 5  10 6  o 0 34.9991  0.163232  1.64287      -0.21283     -4.72822     3.95585      153.765    66.6161      69.8227   116.454      
1 1 1 5  10 7  o 0 14.3687  1.17604   58.4822      -24.0382     -12.5058     12.4892      68.0481    -20.4271     43.5803   12.9732      
1 1 1 5  10 8  o 0 9.46831  0.671338  -0.878522    27.3333      6.52231      0.457897     57.1933    76.7235      58.868    50.075       
1 1 1 5  10 9  o 0 35.5977  1.96642   135.892      -3.14066     -37.667      2.25657      103.097    22.4711      76.9092   -162.09      
1 1 1 5  10 10 o 0 31.7706  0.311077  -5.36217     -1.34776     -6.54317     -2.6399      144.662    -86.9396     84.1717   -32.4191     
1 1 1 5  10 11 o 0 21.2009  0.555886  -13.074      -11.0187     -0.701736    -4.69239     56.5019    -158.546     50.9854   22.274       
1 1 1 5  10 12 o 0 23.0489  1.08754   -36.8382     18.1169      -6.49735     8.71008      91.919     141.574      10.8719   -171.399     
1 1 1 5  10 13 o 0 16.2923  1.09415   -69.139      10.4964      -24.2005     7.81073      55.9174    131.188      27.7229   53.6547      
1 1 1 5  10 14 o 0 29.7683  0.290468  2.30047      -5.69559     1.36334      1.64794      123.976    -7.16902     27.2168   -42.517      
1 1 1 5  10 15 o 0 55.0808  0.791436  22.692       0.671205     -9.85515     -1.97858     223.905    -53.3923     28.4096   -45.8267     
1 1 1 5  10 16 o 0 17.6089  0.555193  -9.39765     2.0856       -2.68349     0.98662      62.7206    130.195      11.5558   -119.312     
1 1 1 5  10 17 o 0 24.6061  0.439308  1.11308      -1.47164     0.266218     0.520806     119.465    -12.3645     39.9099   -13.3081     
1 1 1 5  10 18 o 0 14.802   0.28171   0.204658     0.234924     0            0            72.578     67.29        30.4163   66.0156      
1 1 1 5  10 19 o 0 10.2421  0.233811  -0.0156494   0.561219     0            0            28.7306    34.4298      21.1645   -168.546     
1 1 1 5  11 0  o 0 30.2688  0.198569  2.53792e-17  0.0828948    0            0            118.3      90           31.5263   -90          
1 1 1 5  11 1  f 1 37.1292  0.779129  -5.39407     -14.2717     2.63305      -2.17109     185.704    -122.848     89.6751   -119.668     
1 1 1 5  11 2  o 0 41.1578  0.179063  -1.86398     -4.32653     10.0371      -7.5184      133.047    -21.55       57.5263   132.807      
1 1 1 5  11 3  o 0 23.4649  0.443122  -5.48898     4.98804      -0.2477      1.85823      77.9646    164.983      35.0359   46.0593      
1 1 1 5  11 4  o 0 12.3353  0.667165  10.4068      -40.5384     22.2813      12.4813      68.801     -92.7363     94.6725   -86.3234     
1 1 1 5  11 5  o 0 34.1248  0.803292  0.694289     18.2193      6.09825      -0.358101    98.8974    51.8141      62.8274   -115.619     
1 1 1 5  11 6  o 0 42.2508  0.237271  -3.94938     -0.394165    -3.21641     0.0696062    151.947    -99.2841     49.2335   153.314      
1 1 1 5  11 7  f 1 42.2731  1.16799   -9.20267     -27.575      6.58565      -5.41169     182.229    -70.4717     63.6209   -131.1       
1 1 1 5  11 8  o 0 12.596   1.29498   -10.0612     -102.816     29.9587      -6.07362     60.4117    -90.2624     54.2596   -42.9042     
1 1 1 5  11 9  o 0 18.9255  0.301576  -3.63905     4.69825      0.614285     2.21003      56.3775    153.461      27.3817   -50.8526     
1 1 1 5  11 10 o 0 20.7836  1.28675   -19.9062     53.8597      10.932       9.60145      75.1161    112.561      12.9415   -26.2254     
1 1 1 5  11 11 o 0 22.1088  0.202023  -2.57478     -14.5132     31.2421      -7.9238      103.463    -178.224     34.7969   -164.64      
1 1 1 5  11 12 o 0 12.3046  0.102298  0.945243     1.25613      0.639542     -4.05059     51.8806    151.541      48.983    -144.747     
1 1 1 5  11 13 o 0 23.4688  0.363863  6.66291      15.8643      6.76859      -7.49444     106.559    132.141      41.0808   163.212      
1 1 1 5  11 14 o 0 60.5406  0.314868  -1.24262     -5.36865     8.76056      1.24137      251.217    -164.371     40.8266   -173.407     
1 1 1 5  11 15 o 0 17.2042  0.121798  0.307142     -0.188401    2.19352      0.196169     72.5545    170.323      33.5036   -114.994     
1 1 1 5  11 16 o 0 24.0594  0.220708  1.81694      -3.29367     0.830644     2.62285      86.1813    -126.996     25.5814   35.3124      
1 1 1 5  12 0  o 0 14.5258  0.122873  1.95701e-17  0.0639208    0            0            44.7533    -90          6.6424    -90          
1 1 1 5  12 1  o 0 31.5209  0.958105  22.3038      -26.4157     1.82149      9.19343      159.787    -76.4383     117.113   -36.4445     
1 1 1 5  12 2  o 0 20.1655  0.428109  12.5925      0.972888     -4.74187     -0.574446    75.2676    46.138       0.885198  92.9159      
1 1 1 5  12 3  o 0 15.8585  0.725971  -36.4495     -3.04668     -13.7188     -2.46284     91.5357    -143.538     72.3738   -169.974     
1 1 1 5  12 4  o 0 35.3283  0.832889  -27.4853     0.802076     -5.93988     0.501374     133.92     -164.542     46.5834   91.7087      
1 1 1 5  12 5  f 1 43.2801  0.427232  9.57803      11.441       0.669307     -5.57435     195.783    102.429      56.4753   68.0957      
1 1 1 5  12 6  o 0 74.1385  0.73202   15.305       -3.09842     -11.3271     1.64163      307.952    -76.8738     27.4753   -36.3662     
1 1 1 5  12 7  f 1 21.4515  0.576285  7.74607      -10.8261     1.08216      3.35585      68.1794    -80.1011     33.8215   77.3872      
1 1 1 5  12 8  o 0 10.4124  0.259729  5.5258       -1.08074     -2.40133     0.938647     24.8634    0.621103     17.8284   169.827      
1 1 1 5  12 9  o 0 38.2913  0.221318  -0.564271    -0.960074    -7.04941     -3.90439     161.827    -75.6899     25.2838   -102.448     
1 1 1 5  12 10 o 0 15.8373  0.240433  -9.93881     1.01907      -20.2479     2.7781       43.5772    98.2554      37.9892   -99.7557     
1 1 1 5  12 11 o 0 12.5254  0.401101  4.85687      9.55913      2.90595      -3.74033     14.9617    18.1335      65.5508   -173.298     
1 1 1 5  12 12 f 1 35.9511  1.67056   -68.5096     7.24542      -20.5697     3.69543      164.928    -166.201     56.7753   -160.091     
1 1 1 5  12 13 o 0 29.7863  0.506066  -10.1005     1.11267      -5.3448      0.576853     134.019    110.43       43.7444   125.185      
1 1 1 5  12 14 o 0 11.9728  0.131988  0.206846     0.101992     -0.423624    0.204661     46.1268    101.285      13.6985   13.424       
1 1 1 5  12 15 o 0 9.14766  0.918315  -12.6731     -9.07648     -1.03775     -3.23122     60.9269    -148.157     55.1431   -133.882     
1 1 1 5  12 16 o 0 16.529   0.881033  -9.38722     -0.0797467   -3.3447      0.657811     70.9192    145.386      10.4164   150.213      
1 1 1 5  13 0  o 0 16.9145  0.131988  -1.34287e-17 -0.0731022   0            0            56.9124    90           19.4827   90           
1 1 1 5  13 1  o 0 51.2522  0.482658  1.72525      -6.34149     9.49295      2.69776      222.979    -159.245     73.0754   139.858      
1 1 1 5  13 2  o 0 20.8288  0.231297  -2.18708     -1.45015     -0.634805    -1.33855     77.2771    -86.6347     10.3102   141.261      
1 1 1 5  13 3  o 0 45.9331  0.226094  -0.700006    0.00314194   -0.725975    -0.741001    185.771    111.235      4.67752   -177.244     
1 1 1 5  13 4  f 1 50.451   0.602734  7.11395      -10.1646     1.5926       3.16794      195.415    -5.99782     21.544    -138.471     
1 1 1 5  13 5  o 0 39.7474  0.748134  -2.61141     -18.6322     16.9488      -3.08413     186.115    -169.472     57.0589   172.926      
1 1 1 5  13 6  f 1 31.7272  0.381038  9.09061      -2.31387     -2.33167     1.45534      135.1      28.4856      22.1934   1.79772      
1 1 1 5  13 7  o 0 37.1161  1.61974   5.2286       -52.5868     15.1378      3.58226      158.152    -103.76      28.0806   -132.258     
1 1 1 5  13 8  o 0 14.9046  0.257037  -0.154486    -2.63686     0.964984     -0.0392134   57.3663    -141.261     9.93312   -74.2169     
1 1 1 5  13 9  o 0 10.9823  0.206667  -1.57608     -4.94733     2.29024      -1.73589     43.9944    -52.8563     9.03057   -88.8303     
1 1 1 5  13 10 o 0 44.7071  0.402881  2.03781      -1.10297     -1.11978     0.948189     198.532    -103.19      52.0936   -94.4017     
1 1 1 5  13 11 o 0 26.8394  1.60195   2.31774      95.321       38.9623      -0.99481     104.885    39.3326      12.7771   113.868      
1 1 1 5  13 12 o 0 12.3081  0.126049  0.276674     -0.0494707   -0.921175    -0.0691603   27.0359    94.7821      43.4102   -40.3062     
1 1 1 5  13 13 o 0 18.4429  0.404935  1.20162      -12.9718     8.20492      0.838267     103.415    -22.1087     56.1754   -35.7646     
1 1 1 5  13 14 o 0 11.2075  0.168224  -0.7002      0.957436     0.103367     1.02384      37.6186    -173.043     16.2156   -33.6423     
1 1 1 5  13 15 o 0 15.0842  0.802821  0.179483     5.04504      1.1842       -0.329532    71.5475    110.648      23.8473   108.495      
1 1 1 5  13 16 o 0 16.8428  0.309316  0.479849     0.271358     -0.32467     0.102369     71.2299    -151.703     10.9481   -131.106     
1 1 1 5  14 0  o 0 39.9112  0.32926   -8.45526e-17 -0.460283    0            0            162.73     90           44.8638   90           
1 1 1 5  14 1  f 1 22.1486  0.127095  -0.467659    -4.5022      1.16374      -0.187354    76.2578    -110.969     22.4949   68.9978      
1 1 1 5  14 2  o 0 24.9581  0.290466  9.55614      7.41631      -1.25878     -6.34922     96.2366    -21.9399     11.7678   -147.389     
1 1 1 5  14 3  o 0 9.48159  0.220324  1.43925      -0.112221    -0.407469    0.0928667    11.4958    -94.4691     48.9508   -8.35597     
1 1 1 5  14 4  o 0 22.0112  0.686275  -16.2174     6.71071      -5.42273     5.02421      108.418    108.501      46.5914   91.3711      
1 1 1 5  14 5  o 0 15.0526  0.111457  -0.521697    -2.63985     1.2709       -0.610713    68.5173    -41.7663     24.9337   -61.093      
1 1 1 5  14 6  o 0 29.9062  1.42772   -58.5904     -3.43338     -24.5625     -3.58819     116.907    126          37.8069   36.8964      
1 1 1 5  14 7  o 0 33.3782  0.393158  -10.5115     -4.75553     -1.84246     -1.72903     122.311    -114.527     32.4169   128.49       
1 1 1 5  14 8  o 0 40.8771  0.365036  11.4229      6.83134      -1.84833     -2.79748     177.639    -30.2775     45.2035   3.74599      
1 1 1 5  14 9  o 0 24.0507  0.147531  -2.43982     2.47714      0.0411937    0.816231     63.7084    -178.818     58.2075   12.5812      
1 1 1 5  14 10 o 0 12.3156  1.5219    105.594      -9.79522     -27.8421     5.02985      52.8504    -9.73701     15.1453   -4.91795     
1 1 1 5  14 11 o 0 39.0485  0.241018  -0.458826    1.94966      0.401153     0.0681146    192.614    2.40905      57.8477   10.5674      
1 1 1 5  14 12 f 1 44.9865  0.29352   -7.57483     -3.10157     -12.1089     -3.02599     172.983    -92.6537     31.34     72.7691      
1 1 1 5  14 13 o 0 26.2129  0.195833  0.250781     -0.212914    -0.015927    0.0106107    117.885    21.3332      20.7243   18.1699      
1 1 1 5  14 14 o 0 18.9539  0.169237  -0.0907022   -0.387306    0.0268788    -0.127686    76.257     -31.6397     3.04444   -120.01      
1 1 1 5  14 15 o 0 23.8335  0.320437  0.248951     0.73947      -0.0866685   0.475277     90.8295    72.7807      10.4553   -84.519      
1 1 1 5  15 0  o 0 41.5728  0.381352  1.87969e-17  0.0613954    0            0            168.762    90           15.3496   90           
1 1 1 5  15 1  o 0 24.4189  1.15441   -9.45684     27.4681      6.19545      4.56222      104.809    119.841      17.4648   126.071      
1 1 1 5  15 2  o 0 12.3015  0.741082  1.71479      -20.4027     6.17849      0.894436     40.3686    -99.1422     34.1318   4.23615      
1 1 1 5  15 3  o 0 30.0933  0.411505  -6.85403     0.157668     -2.19282     0.319587     132.721    176.987      29.3746   -177.971     
1 1 1 5  15 4  o 0 4.64214  0.302237  -0.339398    -4.75075     1.46611      -0.217361    21.6123    -115.686     28.4655   -155.463     
1 1 1 5  15 5  o 0 23.3791  1.606     5.96624      58.7227      14.9974      -2.73855     116.665    87.1976      52.7225   82.3048      
1 1 1 5  15 6  o 0 17.285   0.183533  -0.0363415   -0.154244    1.10444      0.655335     72.3664    -154.891     15.3575   172.003      
1 1 1 5  15 7  o 0 24.1034  1.05046   -8.68439     29.3901      11.5573      8.13247      99.7977    50.6694      12.3597   42.4643      
1 1 1 5  15 8  f 1 19.5822  0.15458   -0.686453    5.33451      3.90824      0.438335     84.4236    163.548      8.46742   95.7507      
1 1 1 5  15 9  o 0 6.61182  0.255136  -1.15135     -1.55854     0.5358       -1.27191     22.5029    -175.18      2.58777   -130.057     
1 1 1 5  15 10 o 0 12.1183  0.137068  -0.292804    -0.114994    2.27407      -0.911856    57.8986    -11.6189     20.3743   18.5867      
1 1 1 5  15 11 o 0 3.81146  0.848211  0.321896     -5.90261     1.72456      0.298549     17.3441    -85.2355     11.513    -57.2429     
1 1 1 5  15 12 o 0 23.9665  0.235737  0.778613     -0.76278     0.190832     0.123841     89.6945    -63.3841     17.4724   106.711      
1 1 1 5  15 13 o 0 32.293   0.446441  -0.946333    -2.03121     1.60795      1.09271      135.224    -153.412     6.72263   -147.571     
1 1 1 5  16 0  o 0 8.61394  0.31344   2.80454e-17  0.0916032    0            0            32.4522    -90          3.31429   90           
1 1 1 5  16 1  o 0 13.854   0.532201  -11.1938     2.05702      -3.90142     1.58742      56.2483    126.737      14.1916   -164.945     
1 1 1 5  16 2  o 0 24.9767  0.481357  -5.97719     -7.97356     0.839982     -2.4577      110.11     -105.753     24.225    -112.816     
1 1 1 5  16 3  o 0 28.6897  1.11865   -20.699      -2.79088     -5.51603     -1.02709     113.935    -151.217     3.40443   -99.2427     
1 1 1 5  16 4  f 1 36.5228  0.462872  -4.52119     2.37535      -0.421981    1.02434      193.699    55.7341      74.7706   73.3733      
1 1 1 5  16 5  o 0 6.16777  0.202569  0.797053     0.310576     -0.287567    -0.336632    6.72243    4.2166       27.3533   -164.74      
1 1 1 5  16 6  o 0 26.5225  0.703304  6.47956      0.445587     -3.81466     -1.15384     104.87     23.993       18.3481   170.237      
1 1 1 5  16 7  o 0 19.6813  0.367381  -3.6928      0.564894     -5.63093     -0.117908    78.4572    97.5867      45.5919   3.12999      
1 1 1 5  16 8  o 0 20.7696  0.222625  -1.51865     -1.49677     -0.74958     -1.67379     76.1244    -61.2926     27.245    155.686      
1 1 1 5  16 9  o 0 24.7653  1.80605   -13.275      0.297725     -2.64385     -0.344878    97.4849    -179.538     13.4399   27.2924      
1 1 1 5  16 10 o 0 4.98083  1.21363   8.77699      -0.519296    -1.7769      0.286581     33.1352    -8.75826     34.4224   -30.8711     
1 1 1 5  16 11 o 0 14.5064  0.474693  -0.687725    0.0402968    -0.104378    -0.0303061   48.8726    -120.588     19.2547   73.3174      
1 1 1 5  17 0  o 0 19.5295  0.272672  1.52347e-17  0.0497603    0            0            86.74      -90          14.7988   -90          
1 1 1 5  17 1  o 0 23.7992  0.317184  0.0397075    0.0816898    0            0            104.701    152.075      3.25273   139.375      
1 1 1 5  17 2  o 0 21.0927  0.29915   -0.669856    0.188465     0            0            103.989    -143.778     28.2501   -152.613     
1 1 1 5  17 3  o 0 18.1989  0.286675  0.237669     0.121398     0            0            84.5722    176.907      14.3269   173.276      
1 1 1 5  17 4  o 0 28.4851  0.389579  -0.754768    -0.0246744   0            0            110.087    -147.048     25.418    37.6702      
1 1 1 5  17 5  o 0 27.0148  0.374202  -0.753757    0.196063     0            0            123.545    -141.448     16.7026   -151.505     
1 1 1 5  17 6  o 0 20.8495  0.323488  0.402757     -0.29957     0            0            101.587    -30.1165     28.196    -30.7648     
1 1 1 5  17 7  o 0 17.3003  0.273107  -0.394646    -0.0610207   0            0            67.9832    -125.429     7.91827   71.808       
1 1 1 5  17 8  o 0 2.54951  0.444834  0.16636      -0.0130713   0            0            13.1726    -139.716     35.9932   -142.568     
1 1 1 5  17 9  o 0 14.1563  0.256672  0.195543     -0.121636    0            0            56.7279    -64.165      1.17291   37.1007      
1 1 1 6  0  0  o 0 31.3911  0.298195  -0.0132359   1.62093e-18  0            0            129.273    0            56.0314   180          
1 1 1 6  0  1  o 0 83.2616  0.48835   -1.86967e-16 -1.0178      0            0            348.915    -90          54.6651   -90          
1 1 1 6  0  2  o 0 102.396  0.639571  0.231477     0            0            0            420.12     0            76.0705   1.31052e-15  
1 1 1 6  0  3  o 0 65.3238  0.462848  5.06795e-17  0.165532     0            0            270.871    90           3.15665   90           
1 1 1 6  0  4  o 0 9.13236  0.124225  -0.00090681  1.11052e-19  0            0            6.50624    0            11.7202   180          
1 1 1 6  0  5  o 0 9.39681  0.126002  1.2089e-17   0.0394856    0            0            31.5331    90           77.1328   -90          
1 1 1 6  0  6  o 0 61.0139  0.436116  -0.0695269   8.51459e-18  0            0            256.724    180          23.9718   -180         
1 1 1 6  0  7  o 0 61.8587  0.441401  5.92653e-17  0.193575     0            0            247.667    -90          27.246    90           
1 1 1 6  0  8  o 0 22.8145  0.227831  0.0415626    0            0            0            89.0987    -180         3.36914   1.36804e-13  
1 1 1 6  0  9  o 0 53.9314  0.356426  -5.88205e-18 -0.0320204   0            0            214.318    -90          36.0433   90           
1 1 1 6  0  10 o 0 51.9403  0.372746  -0.0160485   1.96537e-18  0            0            205.161    0            9.88771   0            
1 1 1 6  0  11 f 1 5.97495  0.170782  -5.43038e-18 -0.0295616   0            0            0.361183   90           6.48185   -90          
1 1 1 6  0  12 o 0 8.06846  0.140077  -0.0246457   3.01822e-18  0            0            11.4489    180          10.083    -3.23028e-14 
1 1 1 6  0  13 o 0 14.6424  0.15542   -3.79156e-18 -0.0206403   0            0            46.7403    90           7.63896   90           
1 1 1 6  0  14 o 0 12.1491  0.146385  -0.0109024   1.33516e-18  0            0            12.4086    0            1.20365   0            
1 1 1 6  0  15 o 0 25.8244  0.194087  5.06983e-17  0.165593     0            0            103.744    -90          4.00043   90           
1 1 1 6  0  16 o 0 28.2595  0.203766  -0.0784342   9.60542e-18  0            0            112.314    180          7.08504   -0           
1 1 1 6  0  17 o 0 4.78539  0.171376  1.53369e-17  0.050094     0            0            10.6844    90           19.5899   -90          
1 1 1 6  0  18 o 0 14.9064  0.139566  0.0447248    0            0            0            57.88      180          15.94     -0           
1 1 1 6  0  19 o 0 57.7624  0.356161  1.77619e-16  0.580148     0            0            221.613    90           21.2474   90           
1 1 1 6  0  20 o 0 47.8602  0.333026  0.384056     0            0            0            200.584    -180         39.5537   180          
1 1 1 6  0  21 o 0 23.7255  0.206825  -6.75954e-17 -0.367972    0            0            98.1405    -90          6.13489   -90          
1 1 1 6  0  22 o 0 6.19677  0.292477  -0.0217571   2.66447e-18  0            0            19.2997    0            1.68612   180          
1 1 1 6  1  0  o 0 45.7034  0.336654  -0.456057    5.58509e-17  0            0            187.46     180          17.106    -180         
1 1 1 6  1  1  o 0 59.7909  0.467159  0.160207     -0.178032    -0.0785439   -1.38256     211.403    -72.4224     64.905    66.5029      
1 1 1 6  1  2  o 0 28.1463  1.22268   6.78448      54.5368      19.5341      -5.22996     100.451    145.502      104.779   -132.134     
1 1 1 6  1  3  f 1 26.3365  1.08706   2.69271      -14.2148     3.31456      1.24057      67.8281    -74.1988     97.7795   160.349      
1 1 1 6  1  4  o 0 35.5898  1.67807   -1.17899     -41.4292     12.3422      -0.857657    112.703    -114.12      85.1738   18.289       
1 1 1 6  1  5  o 0 41.0587  0.200978  0.155345     0.639919     0.426196     -0.0863815   159.155    156.806      14.2333   -1.11034     
1 1 1 6  1  6  f 1 41.5574  0.444796  1.5873       22.0403      18.8301      -1.87842     210.656    19.4036      88.7674   47.1658      
1 1 1 6  1  7  o 0 16.1604  0.403294  1.32363      -5.15461     1.57504      0.910975     36.4357    -67.2599     42.4945   150.311      
1 1 1 6  1  8  o 0 90.349   0.519937  -0.198283    -0.174663    0.00717937   -0.00521675  375.173    -108.819     38.1545   -110.725     
1 1 1 6  1  9  o 0 63.8374  1.01825   -0.936618    5.99102      1.13398      0.315778     248.073    121.599      10.5624   20.7175      
1 1 1 6  1  10 o 0 78.0685  0.644344  -2.1683      -13.65       3.35672      -0.8939      327.639    -107.933     47.4953   -111.503     
1 1 1 6  1  11 o 0 49.3106  0.25534   -0.808405    -0.311417    -0.0829605   -0.0619034   162.567    103.301      59.0004   -96.0599     
1 1 1 6  1  12 o 0 47.3766  0.533097  1.43271      6.34844      5.51202      -3.35201     178.426    3.51508      40.2139   -99.3939     
1 1 1 6  1  13 o 0 30.4722  0.904445  -20.8976     15.0071      -1.64919     4.64753      126.591    138.06       30.0856   178.628      
1 1 1 6  1  14 o 0 57.2172  0.267594  0.229646     -0.369254    -0.00696884  0.0348552    247.926    -61.1652     60.4192   -61.3367     
1 1 1 6  1  15 o 0 21.5536  0.132208  0.65848      -0.503559    1.58959      4.96398      121.133    35.9147      75.0831   46.0597      
1 1 1 6  1  16 o 0 15.521   1.23635   -20.0066     -91.4174     26.391       -12.3706     59.4382    -75.0279     16.7486   -169.14      
1 1 1 6  1  17 o 0 9.72315  0.147817  -0.474757    0.143301     -0.42975     0.502363     25.754     119.39       6.45812   7.84161      
1 1 1 6  1  18 o 0 23.1187  0.124565  1.87823      14.7933      19.4036      -3.62718     97.5521    13.3018      36.9116   70.9054      
1 1 1 6  1  19 o 0 5.02028  0.451608  -6.23054     10.7789      2.53092      4.30266      25.7523    126.808      39.909    166.449      
1 1 1 6  1  20 o 0 12.4435  0.438491  -1.06814     -3.10735     0.455175     -0.297783    53.0124    -96.0197     11.6334   -132.965     
1 1 1 6  1  21 o 0 16.0268  0.270476  1.8445       -2.86738     0.392452     1.11288      64.142     -82.0582     2.68988   -167.3       
1 1 1 6  1  22 o 0 20.2386  0.46832   -1.17574     -0.107015    0            0            93.7535    162.873      26.6822   168.238      
1 1 1 6  2  0  f 1 16.3829  0.157186  0.006444     0            0            0            14.2881    180          1.47393   -180         
1 1 1 6  2  1  o 0 16.4735  0.894238  -134.037     0.990863     -72.6218     0.723635     4.9674     92.173       122.245   -60.6204     
1 1 1 6  2  2  o 0 37.146   1.22845   -21.0836     2.75635      -9.3593      2.80022      176.479    122.959      101.174   87.1311      
1 1 1 6  2  3  o 0 54.9876  0.492964  -0.211677    -0.30483     -0.536042    -0.517524    212.961    -161.028     13.4753   14.0569      
1 1 1 6  2  4  f 1 29.4561  1.05333   23.831       -0.870017    -4.91283     0.323424     76.2037    -2.37398     82.4193   172.576      
1 1 1 6  2  5  o 0 54.4109  1.78922   -39.7232     0.793352     -12.4528     0.746016     235.053    -148.429     30.4574   -119.302     
1 1 1 6  2  6  o 0 54.1035  0.253904  0.341956     -0.0392196   -0.141518    0.0416783    233.78     18.8176      49.7916   20.1179      
1 1 1 6  2  7  f 1 60.2421  0.277988  -1.34369     0.0893326    -3.01432     2.10844      203.197    -100.6       114.818   141.378      
1 1 1 6  2  8  o 0 14.1156  0.606758  16.0078      2.18521      -7.77741     -2.09363     30.6792    75.8975      40.9609   -169.561     
1 1 1 6  2  9  o 0 10.1189  0.493219  -14.3456     7.42146      -2.42555     3.40639      25.7553    -121.006     92.9447   -71.0669     
1 1 1 6  2  10 o 0 36.1301  0.694395  15.3852      -2.94026     -5.72499     2.4523       114.154    35.966       51.8859   -123.756     
1 1 1 6  2  11 o 0 52.7292  1.00747   16.3181      -6.38006     -5.49014     5.51126      199.706    -34.7417     21.5119   -122.377     
1 1 1 6  2  12 o 0 33.3315  0.726858  14.8874      9.33204      -1.64617     -3.69157     180.392    14.1959      110.416   20.4979      
1 1 1 6  2  13 o 0 31.1373  0.176259  -0.150514    0.0854613    -0.970155    0.41511      116.092    -111.916     10.7529   -11.377      
1 1 1 6  2  14 o 0 31.5933  1.25245   -53.2131     -12.2581     -10.814      -5.05565     125.288    -167.342     19.53     -122.204     
1 1 1 6  2  15 o 0 34.1985  0.293343  -7.02453     2.67842      -3.09734     3.22817      131.524    -137.455     34.1252   126.089      
1 1 1 6  2  16 o 0 35.6613  0.179116  3.3823       0.815546     -1.19629     -0.723377    160.06     59.2561      42.4773   60.8449      
1 1 1 6  2  17 o 0 18.8966  1.43346   78.0135      -31.0673     -13.3713     12.4468      105.731    -25.5868     100.422   -63.0354     
1 1 1 6  2  18 o 0 23.4677  0.33789   6.7829       1.84898      -3.79818     -1.98534     101.539    -43.4922     33.9827   -79.8185     
1 1 1 6  2  19 o 0 21.5238  0.549643  -14.0548     1.36313      -5.01514     1.22886      109.695    131.583      59.4533   132.301      
1 1 1 6  2  20 o 0 34.4887  0.414608  -15.2787     -2.23787     -5.66797     -2.58104     153.369    137.319      22.0845   147.169      
1 1 1 6  2  21 o 0 25.8521  1.36247   -26.6412     11.4011      -3.57373     3.40442      106.542    161.664      8.62078   91.5324      
1 1 1 6  2  22 o 0 23.7565  1.33552   -2.42975     -0.353701    -0.123944    -0.0706377   92.7754    154.115      7.69242   -81.6978     
1 1 1 6  3  0  o 0 18.9578  0.164721  0.090294     0            0            0            13.6839    0            9.14516   -9.80899e-14 
1 1 1 6  3  1  o 0 37.5377  1.51569   -5.88877     -32.2329     4.0556       -1.50497     84.7551    -89.4123     145.375   49.1139      
1 1 1 6  3  2  o 0 39.9689  0.471869  4.15598      11.2325      2.59891      -2.08204     167.911    95.5684      30.1796   61.8512      
1 1 1 6  3  3  o 0 22.3013  1.55482   3.68934      65.3819      25.1498      -3.02878     98.4469    139.001      30.3476   177.85       
1 1 1 6  3  4  o 0 39.4941  1.1873    2.05221      18.3261      5.18103      -1.29934     217.697    108.572      126.677   104.3        
1 1 1 6  3  5  o 0 69.1131  0.338873  -0.533169    -0.932229    1.59279      -0.618212    272.48     173.52       19.6004   -33.0172     
1 1 1 6  3  6  o 0 57.3611  1.23823   1.28519      17.373       4.92524      -0.927021    199.31     103.172      45.7222   -89.4638     
1 1 1 6  3  7  o 0 47.5497  0.594246  0.601336     14.6526      7.92807      -0.208774    152.215    31.0095      86.3649   165.335      
1 1 1 6  3  8  o 0 35.673   0.166044  0.156284     -0.0109824   -0.0403376   -0.0149049   139.369    22.2719      13.2709   18.1844      
1 1 1 6  3  9  o 0 45.107   1.29261   -9.64549     -55.4263     15.0672      -5.56358     155.688    -88.3895     33.9433   67.0656      
1 1 1 6  3  10 o 0 86.7501  0.575619  -0.991235    -2.32988     0.703335     -0.976996    441.932    -73.7472     208.704   -72.133      
1 1 1 6  3  11 o 0 37.2675  0.334981  4.98263      1.87415      -0.525949    -0.474368    183.987    19.9574      90.5708   20.1745      
1 1 1 6  3  12 o 0 36.5336  0.364995  -3.03477     -2.53017     -0.748276    -2.44182     143.982    -70.2203     26.3065   -137.662     
1 1 1 6  3  13 o 0 19.1473  1.34898   -7.15123     63.1255      13.7633      3.09746      47.5469    78.7606      72.7803   -38.4655     
1 1 1 6  3  14 o 0 38.4392  0.191525  0.994943     0.243942     -0.230974    -0.0667992   161.976    42.0716      37.8921   40.8553      
1 1 1 6  3  15 o 0 14.7488  0.451325  -0.00192498  31.1131      24.2648      -0.496846    69.3001    20.0679      39.0955   14.7306      
1 1 1 6  3  16 o 0 13.4335  0.101318  -1.54967     -1.39812     0.876727     -8.37779     49.7559    120.457      44.9906   37.3319      
1 1 1 6  3  17 o 0 25.0039  0.430725  0.276572     3.54632      0.596008     -0.0450419   83.2401    80.1982      23.6915   -100.839     
1 1 1 6  3  18 f 1 33.8959  0.738454  6.19095      24.38        5.60534      -3.32707     148.528    83.7815      40.9048   87.1306      
1 1 1 6  3  19 o 0 15.9306  0.711448  2.98367      50.0665      26.5055      -2.68201     51.6222    -0.170606    59.0607   -91.5342     
1 1 1 6  3  20 o 0 30.959   0.16733   0.781134     0.391905     -0.0483423   -0.0774549   146.29     51.1372      39.4979   49.3829      
1 1 1 6  3  21 o 0 21.8589  0.584414  1.1035       -8.80953     4.52131      0.734654     79.3114    -39.1686     26.9108   88.3008      
1 1 1 6  3  22 o 0 3.42341  0.805796  -1.54873     -5.13641     1.23418      -0.90129     14.0549    -108.536     7.36269   -129.953     
1 1 1 6  4  0  o 0 72.4514  0.496235  0.0441418    0            0            0            286.332    180          66.4428   -180         
1 1 1 6  4  1  o 0 19.4804  0.90068   25.8923      1.61013      -6.84606     -0.906734    137.849    -0.0126245   139.89    8.94704      
1 1 1 6  4  2  o 0 111.153  0.521241  -4.24404     1.71931      -9.50979     1.12626      459.225    84.646       77.2547   150.539      
1 1 1 6  4  3  o 0 3.82541  0.221804  0.753578     0.509768     -0.0831429   -0.204046    48.3561    -129.081     113.011   -130.594     
1 1 1 6  4  4  o 0 10.777   0.426601  16.7546      -2.1289      -18.1799     4.84615      70.6198    -18.7214     128.099   12.767       
1 1 1 6  4  5  f 1 40.4192  0.243948  -3.97979     -0.0311756   -2.89316     -0.296162    149.641    111.335      50.9162   -152.85      
1 1 1 6  4  6  f 1 33.7959  0.353055  -2.24686     -0.606222    -0.59164     -0.325948    183.885    -179.341     139.115   -178.244     
1 1 1 6  4  7  o 0 39.5467  0.195563  -0.240855    0.36661      -0.000226307 0.295982     116.247    45.0728      68.4903   -146.864     
1 1 1 6  4  8  o 0 26.5039  0.281815  24.9552      -4.6868      -36.1789     13.3327      124.043    -72.1059     86.9747   -20.256      
1 1 1 6  4  9  o 0 28.7549  0.363748  3.30223      -5.72638     0.821501     1.51828      76.7963    -65.6072     57.8692   114.957      
1 1 1 6  4  10 o 0 20.5161  1.37      -80.3667     24.8503      -17.4043     12.0017      153.756    155.785      177.215   135.392      
1 1 1 6  4  11 o 0 75.2595  0.721951  -2.19699     -4.60986     0.325991     -0.323832    254.046    -175.267     79.0241   -16.4442     
1 1 1 6  4  12 o 0 18.1261  0.934781  33.2687      2.13973      -8.97259     -1.05924     85.0879    12.2993      44.283    -12.3057     
1 1 1 6  4  13 o 0 36.8214  0.351333  -1.11132     0.835251     -0.0335232   0.0866605    129.571    -168.797     20.6991   48.3889      
1 1 1 6  4  14 o 0 32.5575  1.54082   -101.77      12.2383      -26.8218     6.16503      106.802    -175.325     46.622    35.0913      
1 1 1 6  4  15 o 0 47.6589  0.367404  0.0203906    -2.87179     0.430947     0.00784832   192.562    -112.992     14.9168   -91.0014     
1 1 1 6  4  16 o 0 26.1855  0.472551  12.4878      -1.61456     -3.12427     0.910919     116.551    -26.0188     33.8126   -18.7131     
1 1 1 6  4  17 o 0 27.5046  0.149876  2.20089      -2.49483     0.686963     2.30806      108.686    14.3298      8.82551   36.0283      
1 1 1 6  4  18 o 0 37.2824  1.08632   25.16        -6.8975      -7.14322     3.86104      134.466    -18.9334     13.6311   -174.723     
1 1 1 6  4  19 o 0 23.0461  0.41596   5.69059      -2.11784     -0.824448    0.773623     67.4387    -33.4741     36.5517   138.61       
1 1 1 6  4  20 o 0 16.294   0.372351  13.0696      -2.31212     -15.641      3.8416       84.5713    78.7479      45.6771   111.943      
1 1 1 6  4  21 o 0 14.2004  0.293459  0.287164     -0.719898    0.0210965    0.260252     59.3927    -135.886     10.2778   -97.8761     
1 1 1 6  4  22 o 0 30.4166  0.889999  -1.88686     -1.57054     -0.217694    -0.248471    136.014    -28.3613     32.4355   -47.1179     
1 1 1 6  5  0  o 0 24.2817  0.173781  -0.0545832   6.68451e-18  0            0            74.8041    0            33.7638   -1.93734e-14 
1 1 1 6  5  1  o 0 48.5353  0.214815  0.846069     9.25099      7.91547      -1.05901     191.863    14.9397      31.6295   102.128      
1 1 1 6  5  2  o 0 88.745   0.38948   -0.294532    -0.0393009   -0.0116708   -0.0136783   359.425    79.8029      45.6176   83.4875      
1 1 1 6  5  3  o 0 67.7341  1.80677   -5.06173     -48.1383     21.6798      -5.44952     257.749    -39.6934     6.51296   77.1752      
1 1 1 6  5  4  o 0 104.37   0.469476  0.308186     0.253022     0.0658072    -0.0654866   446.059    -32.5297     90.307    -30.3715     
1 1 1 6  5  5  f 1 11.6675  0.659154  1.2314       14.5708      5.27075      -0.853395    30.004     43.6283      87.9116   -17.8532     
1 1 1 6  5  6  f 1 23.1078  0.128096  -0.247468    -0.280774    0.995462     -1.58639     87.3093    -37.5382     57.7705   -113.499     
1 1 1 6  5  7  f 1 23.7677  1.62518   14.6678      125.067      30.7525      -7.43508     28.5773    78.197       122.709   -90.1078     
1 1 1 6  5  8  o 0 15.555   0.260759  3.70983      2.41963      -0.681822    -1.5085      30.3915    41.8466      37.602    -131.362     
1 1 1 6  5  9  o 0 27.539   1.3256    19.9884      88.1354      28.9396      -13.9962     113.163    104.292      60.1443   123.99       
1 1 1 6  5  10 o 0 56.8111  0.266156  0.303967     -0.614768    0.904951     0.476739     256.036    -15.8536     75.9081   -8.97459     
1 1 1 6  5  11 o 0 35.4735  0.326024  2.56775      1.02517      -0.54626     -0.420603    150.873    20.9613      35.6844   23.5757      
1 1 1 6  5  12 o 0 33.9848  0.221161  -0.580566    6.01472      3.47175      0.869596     152.828    163.366      52.9057   145.165      
1 1 1 6  5  13 o 0 32.3839  1.33711   -10.8532     -52.6703     15.7281      -7.12606     122.124    -133.545     19.1145   149.868      
1 1 1 6  5  14 o 0 23.7639  0.132927  0.820758     0.258093     -0.314217    -0.351142    104.356    157.333      44.7306   131.237      
1 1 1 6  5  15 o 0 15.1666  1.58328   -18.8083     -94.7432     21.1199      -8.93516     96.2182    -99.445      78.3753   -92.1818     
1 1 1 6  5  16 o 0 22.636   0.120779  -2.0435      3.44486      1.91152      2.60683      58.0988    -171.581     57.7193   -2.51512     
1 1 1 6  5  17 f 1 13.6277  0.416031  4.97563      6.19967      0.292773     -1.54815     81.4135    45.681       70.0739   50.6901      
1 1 1 6  5  18 o 0 12.3637  0.0920731 -0.315679    0.319233     -0.000387558 0.123019     46.6236    -131.142     9.54986   -170.438     
1 1 1 6  5  19 f 1 34.865   1.94664   -11.7681     -49.6248     12.1398      -5.2472      153.578    -108.561     21.7975   -127.568     
1 1 1 6  5  20 o 0 28.8781  0.26177   0.356132     0.184134     0.275319     -0.184097    103.469    35.0915      27.2604   -135.055     
1 1 1 6  5  21 o 0 24.1074  0.711139  -1.33622     -5.60811     2.40258      -0.300122    90.3462    -137.331     14.8276   80.6269      
1 1 1 6  6  0  o 0 86.057   0.497367  -0.140722    1.72335e-17  0            0            326.27     180          85.165    -180         
1 1 1 6  6  1  o 0 77.8275  0.588403  4.57483      -1.37219     -0.513167    0.269918     316.971    -40.2201     48.3289   -26.8901     
1 1 1 6  6  2  o 0 49.2794  0.322872  -2.51951     -0.460685    -23.7244     2.13361      154.117    -91.3359     70.2002   70.4079      
1 1 1 6  6  3  o 0 60.3302  0.257692  -0.359045    0.0930997    -0.0441915   -0.0134929   235.678    -42.8041     16.0381   -56.035      
1 1 1 6  6  4  o 0 72.7586  0.711764  -9.96591     -0.0190223   -14.06       1.69727      258.626    -102.483     64.7904   23.9827      
1 1 1 6  6  5  o 0 40.3517  0.196756  -2.52718     1.06272      -2.45503     2.2629       112.406    -123.522     82.5692   46.0325      
1 1 1 6  6  6  o 0 56.0364  0.257109  1.66554      0.209888     -0.842407    -0.120368    196.968    122.773      58.1798   3.06845      
1 1 1 6  6  7  o 0 21.7812  0.926704  41.3112      -13.8516     -9.97723     7.6143       40.7391    -43.7105     134.074   -139.013     
1 1 1 6  6  8  f 1 47.8757  1.64734   -81.2669     22.2728      -18.5003     10.7145      206.129    174.448      56.354    142.073      
1 1 1 6  6  9  o 0 29.4266  0.159403  1.61211      1.9966       0.176808     -0.692882    102.371    47.5991      8.17545   -125.721     
1 1 1 6  6  10 o 0 26.811   0.760219  -26.4962     6.89376      -7.39198     3.9592       142.25     -163.072     91.7504   175.527      
1 1 1 6  6  11 f 1 27.679   1.24797   -53.8354     3.48778      -18.7076     2.72974      143.717    -141.49      78.369    -139.128     
1 1 1 6  6  12 o 0 35.3719  0.772595  23.3881      -5.32903     -5.04868     2.21306      136.305    11.6262      60.9305   -65.3168     
1 1 1 6  6  13 o 0 35.7091  0.801733  -15.1974     5.50988      -3.12987     2.78929      143.816    177.691      10.4281   163.019      
1 1 1 6  6  14 o 0 16.2301  1.48022   -111.697     16.9161      -26.7964     8.45856      84.219     171.744      45.7787   165.456      
1 1 1 6  6  15 o 0 35.0863  0.674458  14.7207      0.626324     -3.86669     -0.102477    128.601    34.02        15.663    -117.469     
1 1 1 6  6  16 o 0 27.7749  0.148226  0.127547     -0.262173    -2.60903     1.15069      104.948    -99.2597     5.56975   154.286      
1 1 1 6  6  17 o 0 36.0406  0.804283  -18.1847     0.956661     -4.94087     0.326442     163.759    175.704      56.598    173.615      
1 1 1 6  6  18 o 0 14.9597  0.388815  -15.7014     5.86657      -8.99869     7.3756       39.7373    82.1019      38.0313   -59.4494     
1 1 1 6  6  19 o 0 14.315   0.132923  -0.0286489   0.129411     0.00798203   -0.132431    53.1274    -174.1       6.91457   47.195       
1 1 1 6  6  20 o 0 7.07061  1.04232   11.3572      -1.96059     -3.84558     1.68491      40.2808    10.2405      34.7792   6.02991      
1 1 1 6  6  21 o 0 3.07066  0.33232   1.01166      -0.440671    -0.337187    0.278133     12.9338    48.2328      38.2149   69.9455      
1 1 1 6  7  0  f 1 51.5092  0.331777  -0.0725789   8.88835e-18  0            0            196.015    0            46.2104   7.27384e-14  
1 1 1 6  7  1  o 0 43.9403  0.999505  5.08235      31.5247      11.5956      -4.05947     220.954    42.9675      131.66    28.048       
1 1 1 6  7  2  o 0 81.7826  0.517691  -1.02081     -6.81862     2.05786      -0.363853    369.347    -159.109     122.223   -145.346     
1 1 1 6  7  3  o 0 45.122   1.94584   12.548       120.995      34.1032      -7.43568     147.57     102.872      53.2314   -119.685     
1 1 1 6  7  4  f 1 32.0805  0.171766  -0.81795     -4.08914     5.45783      -2.61348     107.45     156.224      136.15    72.0849      
1 1 1 6  7  5  o 0 39.1286  0.412082  -3.10567     8.53595      3.08728      2.42104      110.862    59.5061      75.7012   -101.594     
1 1 1 6  7  6  o 0 77.7709  1.28283   -7.92916     -37.7828     12.64        -6.22759     285.413    -121.867     43.8756   110.757      
1 1 1 6  7  7  o 0 38.4915  0.834019  6.25378      30.4883      8.87308      -3.67545     124.608    97.9794      40.4591   -99.238      
1 1 1 6  7  8  o 0 71.468   0.331805  -0.520454    -0.92446     0.299828     -0.997387    322.054    -54.14       94.0659   -53.381      
1 1 1 6  7  9  o 0 5.70362  0.602596  -1.85066     -26.6636     12.0442      -1.72635     19.4204    -89.7112     13.5493   -87.2722     
1 1 1 6  7  10 o 0 19.1257  0.11523   0.0636052    3.79012      18.8688      -2.59531     100.072    -175.547     66.0085   -146.72      
1 1 1 6  7  11 f 1 11.0776  0.177159  0.990342     0.29979      -0.148036    -0.114733    32.8659    29.1928      13.9117   -29.1619     
1 1 1 6  7  12 o 0 20.8553  1.48022   20.7815      101.474      30.1045      -13.159      87.3352    112.36       12.0515   101.265      
1 1 1 6  7  13 f 1 8.90691  0.0876769 -0.203288    -0.347961    10.2754      -5.61125     30.2216    -100.672     61.6287   -108.561     
1 1 1 6  7  14 o 0 38.4385  0.195665  -0.465878    -0.102707    -0.0353533   -0.072184    170.806    6.1212       44.4627   4.90614      
1 1 1 6  7  15 o 0 36.3075  0.755138  -3.46586     -18.0132     4.65197      -1.59377     129.874    -138.539     26.2284   -3.03327     
1 1 1 6  7  16 f 1 22.3944  1.31809   -11.3145     -88.2256     24.5966      -6.82353     102.624    -119.824     43.1746   -90.0521     
1 1 1 6  7  17 o 0 32.8869  0.161842  0.303939     -0.103304    -0.25604     -0.477836    114.475    9.53206      18.6335   -156.428     
1 1 1 6  7  18 o 0 6.16858  0.703536  1.01055      12.5862      3.70512      -0.520406    16.933     98.3774      26.6339   -164.303     
1 1 1 6  7  19 o 0 32.1152  1.26755   -1.73077     -18.9124     4.33905      -1.19052     153.965    -69.6852     48.1268   -75.8914     
1 1 1 6  7  20 f 1 7.91683  0.176851  0.0556386    0.545417     0.295391     -0.503564    32.3542    115.738      14.5801   136.478      
1 1 1 6  7  21 f 1 15.8903  0.685991  0.84814      4.7131       1.60848      -0.162335    65.3991    32.1031      10.9159   78.7738      
1 1 1 6  8  0  o 0 63.3435  0.3743    0.127052     0            0            0            241.784    0            30.1122   8.1917e-14   
1 1 1 6  8  1  o 0 40.3308  0.266384  -17.592      -0.506821    -22.5335     -2.21623     163.083    109.266      39.2336   166.859      
1 1 1 6  8  2  o 0 36.0926  0.924157  43.9468      -2.44744     -16.2754     1.97139      117.469    48.3529      53.5538   178.862      
1 1 1 6  8  3  o 0 83.4648  0.340373  -0.04038     -0.226223    -0.0930945   0.185536     307.72     -163.71      27.5938   1.99017      
1 1 1 6  8  4  o 0 46.9061  1.1159    35.6712      6.3972       -9.73628     -3.41315     166.492    14.4614      22.4789   171.671      
1 1 1 6  8  5  o 0 45.3198  0.646301  -28.6514     5.08872      -21.1336     8.29581      207.616    -119.073     65.6123   -114.941     
1 1 1 6  8  6  o 0 98.0288  0.688155  1.83585      -1.24948     -0.0672849   0.121261     430.04     -8.89451     105.658   -12.2642     
1 1 1 6  8  7  f 1 54.3061  0.471601  21.1963      -6.46238     -15.0191     8.59918      225.232    -83.713      86.7215   -20.8185     
1 1 1 6  8  8  o 0 23.0917  0.115664  2.54975      -0.65558     -3.6938      1.54419      106.274    61.6397      80.2388   10.5119      
1 1 1 6  8  9  o 0 41.4969  0.20905   2.87832      0.0241627    -1.7647      0.0843485    162.901    -44.4784     20.3837   -92.2808     
1 1 1 6  8  10 f 1 40.4904  0.181513  -0.424829    -0.401222    -0.077741    -0.309782    150.989    -169.19      2.24589   76.2279      
1 1 1 6  8  11 o 0 44.9655  0.91848   59.1693      -6.70479     -42.1804     12.0401      178.495    69.6544      58.5504   155.449      
1 1 1 6  8  12 o 0 38.1722  0.187036  -0.676374    0.470217     -0.103531    0.198668     156.057    -133.683     18.8403   -159.214     
1 1 1 6  8  13 o 0 13.2829  1.0423    -53.3349     9.45532      -11.8397     4.2433       43.329     178.523      35.8499   -78.3238     
1 1 1 6  8  14 o 0 30.0529  0.558089  3.95334      1.49048      -1.13548     -0.795287    116.613    31.9522      5.15289   73.519       
1 1 1 6  8  15 o 0 26.7585  1.00583   44.5228      -4.48899     -11.9826     2.16273      87.0053    16.6572      34.5165   -128.252     
1 1 1 6  8  16 o 0 26.5248  0.315506  2.75308      0.123759     -0.614153    0.0206823    70.0737    -49.481      60.0995   121.297      
1 1 1 6  8  17 o 0 26.5105  1.65551   -95.8782     14.3839      -21.9827     7.07296      103.295    178.792      10.3774   154.455      
1 1 1 6  8  18 f 1 14.1099  0.220473  -1.62173     -0.0650113   -0.8943      0.125513     63.1134    -100.885     26.4432   -149.764     
1 1 1 6  8  19 o 0 11.0752  0.211347  -0.399855    -0.375819    -0.194113    -0.14808     50.7997    61.4681      23.7795   71.4054      
1 1 1 6  8  20 o 0 3.46309  0.668038  3.10376      -0.281705    -0.806691    0.10321      18.2012    -7.72232     17.2051   -11.0354     
1 1 1 6  9  0  o 0 25.4853  0.169555  0.1132       0            0            0            98.1612    0            6.18311   180          
1 1 1 6  9  1  o 0 28.5063  0.684101  7.84578      17.45        2.70319      -2.97159     156.316    62.5976      105.376   68.1035      
1 1 1 6  9  2  f 1 72.735   0.299124  -0.0348686   3.84078      5.35686      1.33793      297.02     178.733      38.5973   155.008      
1 1 1 6  9  3  o 0 56.29    0.48048   0.614378     -4.9909      1.70548      0.270517     255.231    -81.0502     85.4949   -78.2864     
1 1 1 6  9  4  o 0 36.9473  0.624269  7.25961      19.5902      8.71775      -8.08716     160.484    3.49536      67.8426   -47.1469     
1 1 1 6  9  5  o 0 20.3729  0.15641   -2.69281     0.756027     -1.08807     0.588258     102.227    93.9098      82.4548   131.134      
1 1 1 6  9  6  o 0 37.1072  0.566041  2.64967      29.3447      42.9086      -10.1134     180.239    -5.74267     95.4626   -39.1032     
1 1 1 6  9  7  o 0 50.0966  0.222128  0.114441     1.77614      0.170764     0.0157167    198.803    29.7197      20.7626   63.6237      
1 1 1 6  9  8  o 0 33.6472  0.162277  -0.0870906   0.404937     3.56197      -0.733336    100.676    172.157      68.6493   -53.4968     
1 1 1 6  9  9  o 0 25.6944  0.235463  4.44248      2.80195      -0.507007    -1.1813      90.4826    -15.6191     63.3393   72.7256      
1 1 1 6  9  10 o 0 22.493   0.117548  0.638151     3.19965      37.3694      -3.50298     78.3083    -6.90846     27.7593   -146.805     
1 1 1 6  9  11 o 0 29.4751  0.146959  0.158306     0.31355      0.0353173    -0.0523786   101.155    -33.6049     24.0699   129.375      
1 1 1 6  9  12 o 0 53.9149  0.520435  6.25216      30.8071      22.7043      -6.92357     246.934    10.6717      71.584    10.1484      
1 1 1 6  9  13 o 0 30.2471  0.167292  -1.80618     -2.43314     0.137594     -0.444216    129.155    160.735      33.2792   -165.577     
1 1 1 6  9  14 o 0 14.5658  0.102213  -0.000891976 -0.00822231  -0.00284664  -0.00524619  63.7795    37.6478      45.4748   37.5862      
1 1 1 6  9  15 o 0 19.0646  0.164786  0.093951     0.446958     0.445371     -0.944264    65.6306    77.6164      13.1821   -167.853     
1 1 1 6  9  16 o 0 19.8524  1.27366   -14.0816     -102.032     34.1218      -9.10775     93.59      -137.945     39.1429   -126.402     
1 1 1 6  9  17 o 0 15.6449  0.240276  0.0548916    -0.24512     0.044784     -0.0026476   62.5369    -55.4212     1.91646   -62.1992     
1 1 1 6  9  18 o 0 2.08205  0.424006  -0.231585    3.79228      1.62277      0.151582     12.614     1.03943      32.3591   -17.5678     
1 1 1 6  9  19 o 0 10.3247  0.250513  0.0146593    -0.127945    0            0            37.8735    -79.2029     0.773076  109.702      
1 1 1 6  10 0  f 1 39.4867  0.266638  -0.0393889   4.82375e-18  0            0            152.885    0            6.84257   180          
1 1 1 6  10 1  o 0 52.9277  1.5867    61.328       10.6486      -17.4196     -6.74944     265.372    -23.2964     124.831   -21.1302     
1 1 1 6  10 2  o 0 19.5976  0.314992  -2.84275     0.231075     -0.632019    0.0647043    83.1301    -151.585     34.0891   175.464      
1 1 1 6  10 3  o 0 16.8686  0.192988  -0.329455    2.99779      1.79514      0.4568       94.7683    34.2952      97.3237   67.1384      
1 1 1 6  10 4  o 0 41.5734  0.471455  -1.3952      3.20401      0.330423     0.372591     167.991    45.6716      38.2972   100.07       
1 1 1 6  10 5  o 0 28.8337  1.3749    89.4194      -10.5282     -32.4311     8.07495      107.549    58.6519      90.7533   139.794      
1 1 1 6  10 6  o 0 27.8559  0.132915  0.281653     0.166795     -0.0853233   -0.13905     121.483    -100.699     41.7623   -90.5974     
1 1 1 6  10 7  o 0 29.4937  1.51861   100.172      -9.30047     -30.074      6.05261      89.0169    -18.1389     36.1635   178.341      
1 1 1 6  10 8  o 0 28.601   0.850795  -28.4193     7.72049      -7.82482     4.80213      98.6212    -166.102     28.741    -15.5917     
1 1 1 6  10 9  f 1 42.7499  0.468709  10.8259      -3.64818     -2.00103     1.35358      209.289    8.27049      86.7582   -3.40132     
1 1 1 6  10 10 o 0 36.1358  0.275627  10.3207      -3.44653     -6.209       3.76024      178.162    -87.6771     76.5415   -71.3452     
1 1 1 6  10 11 f 1 37.909   0.439492  -23.5783     -0.257974    -31.732      2.66996      178.171    -103.919     59.9467   -111.739     
1 1 1 6  10 12 o 0 17.2799  0.452392  -9.35718     2.41848      -2.87366     1.42942      78.3526    -151.136     44.2513   161.704      
1 1 1 6  10 13 o 0 20.5128  1.07331   37.3251      2.2432       -10.0476     -1.39731     47.7588    16.278       60.0324   -152.481     
1 1 1 6  10 14 o 0 20.5084  0.544163  22.8142      -7.29384     -8.25487     6.24441      85.5415    35.1489      25.4375   81.7959      
1 1 1 6  10 15 o 0 41.0691  0.810757  16.7524      1.47326      -6.99391     -0.569918    150.728    59.9698      10.8562   -78.232      
1 1 1 6  10 16 o 0 4.21013  0.168173  -0.459299    0.114877     -0.173937    0.0891171    2.08101    -167.276     13.1382   -38.9743     
1 1 1 6  10 17 o 0 8.02072  1.12276   -39.5034     0.614555     -13.2871     0.212926     24.3419    146.104      14.3256   15.9953      
1 1 1 6  10 18 o 0 7.11337  0.257603  -0.0538777   -0.0297553   0            0            21.4575    -91.494      2.68064   110.536      
1 1 1 6  10 19 o 0 6.88477  0.351928  -0.0312052   0.0969588    0            0            2.19982    -1.48758     45.2229   157.602      
1 1 1 6  11 0  o 0 10.3053  0.100896  -0.0785693   9.62197e-18  0            0            17.1814    0            8.15843   180          
1 1 1 6  11 1  o 0 23.1552  0.341711  0.416631     4.59653      1.00096      -0.182485    61.3836    110.475      54.6852   -39.1935     
1 1 1 6  11 2  o 0 63.7273  0.591169  3.13287      -8.22063     2.81282      2.99751      246.849    -124.134     4.64368   -134.669     
1 1 1 6  11 3  o 0 44.8253  0.538653  -2.91824     -17.6129     6.77488      -2.65723     173.418    -123.405     25.0926   167.104      
1 1 1 6  11 4  o 0 24.9902  0.429734  -11.1086     -19.9631     6.1164       -10.6275     119.061    -176.226     54.6695   -150.939     
1 1 1 6  11 5  f 1 32.1614  0.730022  1.04024      13.8488      2.35231      -0.259926    107.379    65.4761      66.008    172.229      
1 1 1 6  11 6  o 0 24.5897  0.58317   1.12816      -44.1964     35.2949      0.97497      145.529    -170.978     106.579   167.049      
1 1 1 6  11 7  o 0 22.9287  0.774646  -7.86146     -42.4789     16.6338      -5.97897     95.8203    -152.604     11.8786   177.171      
1 1 1 6  11 8  o 0 17.8671  0.544882  -3.88212     19.3203      6.12162      2.70845      77.5573    72.4409      38.3976   127.314      
1 1 1 6  11 9  o 0 44.6704  0.217831  -1.94415     -6.55037     13.4077      -4.29143     150.313    178.498      108.907   -72.078      
1 1 1 6  11 10 o 0 43.9135  0.4325    0.103799     -9.73451     8.68114      1.76923      220.407    -8.16488     98.6576   -14.5718     
1 1 1 6  11 11 f 1 20.478   0.352607  0.121251     3.45625      0.505898     -0.0543754   117.025    62.6686      85.9321   67.4827      
1 1 1 6  11 12 o 0 14.431   1.49464   2.62893      -103.236     27.2714      1.60333      59.7797    -93.9922     19.1925   -46.695      
1 1 1 6  11 13 o 0 21.8245  1.40739   -16.1137     -70.6555     14.9154      -7.3935      84.678     -107.584     15.9633   -37.1654     
1 1 1 6  11 14 o 0 18.5897  0.14182   0.119383     0.236665     0.041283     -0.0239859   77.8548    -73.5436     20.3127   -68.0747     
1 1 1 6  11 15 f 1 26.3437  1.10413   4.4082       26.0761      7.07261      -1.93233     100.106    87.7942      16.177    -72.9781     
1 1 1 6  11 16 o 0 39.1006  0.523844  0.441093     8.22419      5.46468      0.883274     156.801    12.4163      22.6527   116.781      
1 1 1 6  11 17 o 0 9.41807  0.197552  -0.125656    0.0752616    0            0            26.9727    -122.499     16.4887   66.4181      
1 1 1 6  12 0  o 0 45.914   0.273876  -0.164869    2.01906e-17  0            0            186.792    0            44.2035   180          
1 1 1 6  12 1  o 0 44.9377  0.897697  -28.9775     -9.56009     -6.46903     -5.16646     186.833    -176.834     15.5456   160.76       
1 1 1 6  12 2  f 1 3.59931  0.338037  -20.8002     2.00594      -19.7818     3.98609      47.6994    52.0039      116.31    53.9694      
1 1 1 6  12 3  o 0 27.9799  0.12505   -0.768211    -1.09771     1.50779      -2.04865     129.404    155.212      61.5797   -159.172     
1 1 1 6  12 4  o 0 33.4594  0.329464  -20.0438     -0.836965    -13.3609     -0.557971    156.28     -107.092     60.971    -69.0741     
1 1 1 6  12 5  o 0 17.6388  0.692069  31.4089      -2.29383     -12.8699     1.66012      75.0936    -48.3058     42.6852   -79.9555     
1 1 1 6  12 6  o 0 8.62473  0.15535   2.68463      -1.23952     -1.16573     1.4082       43.0505    -59.1667     54.685    -38.8553     
1 1 1 6  12 7  o 0 20.1798  0.998396  -40.797      -2.95851     -9.27931     -1.21485     78.6116    -179.742     17.1513   -95.4054     
1 1 1 6  12 8  o 0 29.6023  1.19888   68.149       -9.63065     -27.4281     8.68486      93.3954    54.1446      71.4427   176.334      
1 1 1 6  12 9  o 0 20.4501  0.129835  0.314362     0.0642687    -0.283221    0.0846045    83.2694    -93.9485     12.5333   -81.4149     
1 1 1 6  12 10 o 0 41.1721  0.250187  12.9743      1.1325       -11.5449     -0.134653    191.57     75.113       64.9546   65.0773      
1 1 1 6  12 11 f 1 9.34462  0.554735  25.8207      6.34768      -9.37959     -4.79262     34.0759    12.0307      59.9653   78.7539      
1 1 1 6  12 12 o 0 11.2709  0.709543  31.4866      -7.88548     -9.29211     4.80236      42.9579    -41.5129     4.87331   -49.6987     
1 1 1 6  12 13 o 0 30.3874  0.671384  -7.31438     -1.38969     -1.51218     -0.864874    136.761    160.805      45.7481   164.531      
1 1 1 6  12 14 o 0 11.86    1.63646   66.9976      -3.05422     -18.5273     1.42235      36.2225    -14.9737     21.6698   167.918      
1 1 1 6  12 15 o 0 10.1201  0.606726  -5.96635     -3.04977     -1.06724     -1.35174     48.7517    -125.95      23.5833   -156.108     
1 1 1 6  12 16 f 1 5.49974  0.380688  -1.46914     -0.20516     -0.571951    -0.0746034   22.1546    -136.539     39.2053   175.823      
1 1 1 6  13 0  o 0 27.1514  0.17201   0.170208     0            0            0            110.268    0            0.0411725 180          
1 1 1 6  13 1  o 0 33.7297  0.568538  -8.98006     -20.7859     4.42737      -4.38974     121.996    -77.3212     35.4903   146.575      
1 1 1 6  13 2  o 0 5.30331  0.134269  -1.70389     1.65803      -0.0486839   1.25752      8.9186     -36.1157     47.5217   -37.1184     
1 1 1 6  13 3  o 0 50.853   0.272474  -1.96685     -6.98562     14.337       -2.33286     213.367    179.527      46.583    -117.082     
1 1 1 6  13 4  o 0 15.7839  0.105387  0.91         0.142236     -0.366195    -0.0626364   69.2202    55.8534      21.4167   51.9777      
1 1 1 6  13 5  o 0 31.7633  1.27159   10.277       -23.122      3.27556      3.91093      148.836    -76.4884     48.3262   -69.0848     
1 1 1 6  13 6  o 0 6.41344  0.335314  1.02857      -3.57226     0.867485     0.550225     51.9572    -68.6258     77.7299   -80.8904     
1 1 1 6  13 7  o 0 45.9045  0.86296   -4.06037     -30.7612     10.1971      -3.54203     176.703    -49.8398     20.5692   -159.854     
1 1 1 6  13 8  o 0 31.8782  0.499038  -0.334425    -4.72122     1.58948      0.0490424    139.281    -130.203     32.3295   -132.904     
1 1 1 6  13 9  o 0 17.9805  1.75147   -4.27154     156.754      49.3684      3.12076      70.5589    58.7352      9.95946   135.922      
1 1 1 6  13 10 o 0 25.9124  0.33579   4.44304      -2.41105     -0.40294     0.734821     133.193    14.3609      71.0699   6.48915      
1 1 1 6  13 11 o 0 12.6098  0.137693  0.858238     -4.14509     1.5756       0.614043     31.4042    -31.297      33.8383   -179.854     
1 1 1 6  13 12 f 1 24.1566  0.569162  -1.22956     3.11471      0.485753     0.643552     108.807    112.719      18.6651   107.022      
1 1 1 6  13 13 o 0 22.9832  1.234     -3.02969     -39.09       14.002       -1.53149     76.735     -139.98      39.3132   65.856       
1 1 1 6  13 14 o 0 8.42952  0.184742  -0.24749     0.0924848    -0.00429278  0.0475741    23.7799    -174.96      15.1083   8.65418      
1 1 1 6  13 15 o 0 18.3624  0.311007  -1.44649     4.14032      4.4391       0.520875     63.1812    170.222      22.3935   6.60375      
1 1 1 6  14 0  o 0 11.2294  0.14505   0.072255     0            0            0            45.3538    0            26.0738   -180         
1 1 1 6  14 1  o 0 20.9448  0.118813  -2.39195     0.370448     -0.882616    0.174843     80.708     94.9145      29.188    -174.604     
1 1 1 6  14 2  f 1 27.6517  1.5509    58.8084      -6.5459      -14.1562     3.48683      116.949    2.3979       15.4235   -3.59015     
1 1 1 6  14 3  o 0 11.5427  0.300892  -3.60367     -0.524802    -1.3706      -0.312036    35.7619    -131.802     18.7615   91.8634      
1 1 1 6  14 4  o 0 9.65204  1.69074   -64.9911     -9.56043     -14.5985     -4.47827     38.3363    179.207      15.5386   104.601      
1 1 1 6  14 5  o 0 10.9805  0.107863  -1.58706     0.0646081    -1.54353     0.18657      38.3885    -119.646     20.3054   -43.4383     
1 1 1 6  14 6  o 0 25.6627  0.186674  -1.6706      1.20301      -0.21026     0.981114     109.684    -91.5063     37.9211   -140.439     
1 1 1 6  14 7  o 0 27.1193  0.174707  -0.883443    -0.408488    -0.0588703   -0.0563747   96.9397    155.067      16.5019   -39.1097     
1 1 1 6  14 8  o 0 17.2382  0.387616  21.2749      -1.85921     -41.7553     4.81901      50.1624    -100.6       46.0874   130.843      
1 1 1 6  14 9  o 0 26.0459  0.324414  -2.23281     2.21474      -0.102651    1.2272       95.6591    -170.251     7.58674   25.5485      
1 1 1 6  14 10 o 0 23.6759  1.51265   40.8782      4.66037      -10.6383     -2.90151     99.6195    -21.8078     41.9102   61.8978      
1 1 1 6  14 11 o 0 33.3386  0.227083  2.6621       -0.584452    -0.735753    0.879593     151.237    31.7514      24.7179   33.5062      
1 1 1 6  14 12 o 0 14.3705  0.468613  9.49098      -0.712412    -2.79147     0.572787     70.3427    22.7792      25.7762   21.0746      
1 1 1 6  14 13 o 0 10.7213  0.139856  0.135662     0.0756118    -0.0282066   -0.0278905   40.5884    155.835      2.26693   54.1373      
1 1 1 6  14 14 o 0 22.5949  0.416368  -5.02815     1.04394      -6.23117     -1.77204     70.1619    108.267      42.8488   -75.4077     
1 1 1 6  15 0  o 0 5.62139  0.130361  0.0334258    0            0            0            3.91585    0            2.35569   180          
1 1 1 6  15 1  o 0 32.0761  0.475202  -1.3175      -4.00269     2.03693      -2.3981      155.524    -49.3478     56.1425   -43.9084     
1 1 1 6  15 2  o 0 8.45562  0.357239  1.45689      -4.74488     1.11592      0.710315     30.9641    -67.5121     3.65185   -104.51      
1 1 1 6  15 3  o 0 9.55675  0.555776  1.67156      29.9126      18.2062      -1.77756     33.4114    154.104      8.98617   -42.6212     
1 1 1 6  15 4  o 0 19.374   0.3843    -1.62388     -5.69622     4.08917      -2.03268     83.4533    -173.846     15.9147   -164.743     
1 1 1 6  15 5  o 0 27.2015  0.17811   3.18445      -6.03716     2.26953      2.69478      121.028    -132.813     33.3207   -108.969     
1 1 1 6  15 6  o 0 5.70322  0.982624  2.72572      -30.1453     8.33916      1.57777      29.3184    -92.9627     22.5342   -119.273     
1 1 1 6  15 7  o 0 20.628   0.285704  0.362994     7.95435      4.14949      -0.808649    84.9247    147.915      18.9729   44.5493      
1 1 1 6  15 8  o 0 17.7309  0.142658  -0.37417     -0.23041     -0.439794    -0.161437    76.2414    130.973      7.05412   103.632      
1 1 1 6  15 9  o 0 29.1324  0.5111    -2.84454     15.326       10.0388      1.98153      120.997    161.047      41.4501   -109.264     
1 1 1 6  15 10 o 0 14.3099  0.561933  2.06623      7.3316       3.27613      -1.70964     75.6981    19.3152      34.332    20.1298      
1 1 1 6  15 11 o 0 14.7343  0.321578  -0.246202    -0.322653    0.310268     -0.00300861  62.7969    -145.753     8.22925   -170.008     
1 1 1 6  15 12 o 0 25.6882  0.78613   0.658777     -7.00623     1.12646      -0.0261458   112.51     -53.1145     17.5641   -81.071      
1 1 1 6  16 0  o 0 15.2184  0.242516  -0.0658886   8.06902e-18  0            0            67.6673    -180         8.50715   180          
1 1 1 6  16 1  f 1 4.59091  0.129861  1.85182      0.238198     -5.68596     -2.39314     34.214     22.211       67.6815   1.97654      
1 1 1 6  16 2  o 0 9.58364  0.37939   -3.83103     0.511107     -1.66248     0.537378     11.8616    117.76       56.6957   -34.4016     
1 1 1 6  16 3  o 0 23.9923  0.217614  -1.05518     1.1219       -0.284698    0.854239     107.419    139.691      9.58955   120.848      
1 1 1 6  16 4  o 0 18.7803  1.43896   20.1209      0.871076     -3.56625     -0.47986     89.6124    -11.5497     32.5534   38.4857      
1 1 1 6  16 5  o 0 24.8754  1.36151   -23.9913     0.747213     -8.01783     -0.00469452  125.702    144.71       40.8775   130.859      
1 1 1 6  16 6  o 0 19.6038  0.209994  0.0894556    0.00244577   -0.00407953  0.00585027   87.02      -147.928     10.6221   -145.22      
1 1 1 6  16 7  o 0 16.7859  0.531456  -5.07437     -0.901357    -3.49388     -1.86664     64.5851    125.21       18.5225   -1.83675     
1 1 1 6  16 8  o 0 24.8885  0.24738   1.53588      1.23036      -2.20369     -0.0948345   84.5099    82.4325      40.1829   -96.7405     
1 1 1 6  16 9  f 1 11.6379  0.542107  -2.97695     1.6079       -0.313953    0.740971     56.7832    -175.577     22.671    168.339      
1 1 1 6  16 10 o 0 25.3508  0.256737  2.96103      0.855301     -1.37651     -0.111297    116.294    75.2506      24.6511   60.9582      
1 1 1 6  17 0  f 1 7.30753  0.212672  -0.133706    1.63743e-17  0            0            30.3277    0            4.55049   180          
1 1 1 6  17 1  o 0 7.84219  0.306567  -0.0570331   0.00676423   0            0            29.1508    -46.8909     13.8902   -48.8947     
1 1 1 6  17 2  o 0 10.1931  0.216106  -0.249771    0.0138422    0            0            41.1543    154.181      1.39094   -132.895     
1 1 1 6  17 3  o 0 17.2134  0.277256  -0.0954889   0.078121     0            0            73.8386    121.568      1.88914   131.199      
1 1 1 6  17 4  o 0 7.73951  0.238058  0.325894     -0.204344    0            0            28.5961    -4.32726     3.51179   -81.6499     
1 1 1 6  17 5  o 0 4.13522  0.313819  -0.0232496   0.0276904    0            0            0.365074   165.238      12.7887   96.7515      
1 1 1 6  17 6  o 0 25.446   0.362251  1.64304      -0.0078814   0            0            95.953     64.3177      24.4718   -94.5401     
1 1 1 6  17 7  o 0 12.6135  0.241115  -0.0472028   0.0362129    0            0            47.3874    170.147      6.85529   -7.25507     
1 1 1 6  17 8  o 0 7.8613   0.234585  0.109142     0.116034     0            0            25.0394    163.375      6.51091   6.7789       
1 1 1 7  0  1  o 0 62.0629  0.381134  6.31611e-17  0.2063       0            0            248.563    90           13.4153   90           
1 1 1 7  0  2  o 0 36.6306  0.289804  -0.149995    1.8369e-17   0            0            148.167    180          50.1488   -9.59727e-14 
1 1 1 7  0  3  o 0 3.72827  0.238991  6.2775e-18   0.0205039    0            0            2.07826    90           27.3838   -90          
1 1 1 7  0  4  o 0 8.51469  0.138656  0.00303548   0            0            0            20.4731    180          54.3131   -3.20729e-14 
1 1 1 7  0  5  o 0 56.4942  0.402474  2.31403e-17  0.0755818    0            0            221.969    -90          91.986    90           
1 1 1 7  0  6  o 0 26.6383  0.228895  -0.01421     1.74022e-18  0            0            104.881    0            86.5329   -180         
1 1 1 7  0  7  o 0 55.4103  0.40045   -2.89768e-17 -0.157742    0            0            218.135    -90          44.5912   90           
1 1 1 7  0  8  o 0 101.543  0.683272  0.0178627    0            0            0            398.877    180          32.0893   -180         
1 1 1 7  0  9  o 0 2.64575  0.257221  -1.59604e-18 -0.00868841  0            0            0.790774   90           28.2156   -90          
1 1 1 7  0  10 o 0 29.3956  0.232877  0.0394484    0            0            0            111.887    0            49.934    6.35004e-15  
1 1 1 7  0  11 o 0 3.755    0.213836  -3.66625e-19 -0.00199582  0            0            7.93296    -90          70.5634   90           
1 1 1 7  0  12 o 0 19.3804  0.178935  -0.0817585   1.00125e-17  0            0            75.1452    180          45.9617   -2.0837e-14  
1 1 1 7  0  13 o 0 48.2266  0.35302   6.23469e-17  0.20364      0            0            185.393    -90          8.05148   -90          
1 1 1 7  0  14 o 0 25.7158  0.21212   -0.0138104   1.69129e-18  0            0            102.958    180          27.6943   -0           
1 1 1 7  0  15 f 1 35.8845  0.238073  9.04469e-17  0.295422     0            0            142.209    90           68.9203   90           
1 1 1 7  0  16 o 0 30.5778  0.224007  0.161734     0            0            0            119.875    180          32.204    -180         
1 1 1 7  0  17 o 0 12.9228  0.137811  2.30299e-18  0.00752213   0            0            44.7157    -90          17.8884   -90          
1 1 1 7  0  18 o 0 54.3618  0.342744  0.0650264    0            0            0            208.19     180          12.8839   -1.13183e-13 
1 1 1 7  0  19 o 0 53.2372  0.330417  -1.35432e-16 -0.737258    0            0            201.355    -90          34.0761   -90          
1 1 1 7  0  20 o 0 25.6398  0.187779  0.225401     0            0            0            105.902    0            20.4859   0            
1 1 1 7  0  21 o 0 20.1147  0.301203  -1.07505e-16 -0.585231    0            0            81.9729    -90          18.2234   -90          
1 1 1 7  1  0  o 0 29.062   0.240585  -8.65859e-19 -0.00471352  0            0            105.957    90           55.0263   90           
1 1 1 7  1  1  o 0 24.6259  0.862448  6.1207       -7.8123      0.55814      2.19359      97.155     -46.3251     20.2566   -97.0562     
1 1 1 7  1  2  o 0 68.3011  1.2778    2.7768       -23.32       14.6628      2.62648      283.662    -18.3752     126.575   54.9845      
1 1 1 7  1  3  o 0 127.788  0.920619  0.518799     0.727232     -1.58899     -0.0871358   581.4      4.36063      131.824   7.05376      
1 1 1 7  1  4  o 0 93.4952  1.08108   -0.368655    -8.94313     5.63451      -1.38819     351.794    -37.677      66.3887   107.501      
1 1 1 7  1  5  o 0 61.1175  0.306202  -0.103768    0.255365     0.385972     -1.30046     216.153    143.072      39.088    -33.343      
1 1 1 7  1  6  o 0 71.2618  0.719448  -1.5662      2.20926      0.508194     0.904877     223.694    49.8385      107.723   -142.869     
1 1 1 7  1  7  o 0 87.5852  0.627734  -2.09264     0.974596     -0.312729    1.11426      410.536    -143.723     141.255   -146.642     
1 1 1 7  1  8  o 0 18.6871  0.435684  -4.11739     -32.2505     25.487       -6.38244     54.7499    -159.902     40.8404   -13.8229     
1 1 1 7  1  9  f 1 30.5696  0.172927  -0.263184    0.69519      0.0829973    0.0909791    93.3158    -4.68779     45.7976   136.251      
1 1 1 7  1  10 o 0 26.2044  0.24995   -2.783       -10.064      4.6738       -2.69014     139.966    -52.0219     91.2955   -75.073      
1 1 1 7  1  11 o 0 28.3402  0.172044  -2.77931     3.99288      0.800023     2.62002      80.9133    -171.62      67.2951   50.6139      
1 1 1 7  1  12 o 0 21.2335  0.152409  0.302349     3.63387      2.35808      -0.28479     123.019    159.096      127.596   126.203      
1 1 1 7  1  13 o 0 53.2068  0.251835  -0.0746892   0.342038     0.412126     0.563045     239.318    -6.84735     77.4645   2.11101      
1 1 1 7  1  14 o 0 40.0081  0.197911  1.18529      4.58012      11.7964      -2.88474     192.89     168          69.696    176.513      
1 1 1 7  1  15 o 0 15.251   0.211334  1.0298       2.57914      0.532576     -0.56431     44.1263    93.0913      27.001    -41.6194     
1 1 1 7  1  16 o 0 26.1249  0.141832  0.519462     0.46713      4.71368      -3.5618      114.378    -16.6751     32.2184   -47.6522     
1 1 1 7  1  17 o 0 14.9923  0.413495  10.2108      -11.7444     0.673386     5.82407      60.8972    -11.0057     32.667    -77.8072     
1 1 1 7  1  18 o 0 22.092   0.120829  -0.377302    -1.85333     6.7423       -0.497626    72.0445    -168.943     54.3965   -63.7173     
1 1 1 7  1  19 o 0 14.1779  0.0988209 -1.42316     0.344753     -4.22514     3.97501      77.3455    70.8321      50.5338   63.0173      
1 1 1 7  1  20 o 0 44.7542  1.69403   4.34455      42.8091      11.2493      -3.29967     187.878    99.8792      12.0892   140.898      
1 1 1 7  1  21 o 0 8.11807  0.142831  0.000492242  -0.199524    0.168435     -0.195107    17.9072    -172.889     24.2294   17.6396      
1 1 1 7  2  0  f 1 26.2583  0.219047  -1.40875e-17 -0.076689    0            0            102.972    -90          65.0464   90           
1 1 1 7  2  1  o 0 42.3867  1.3516    -21.8675     -10.8581     -5.00804     -6.28049     163.114    -134.25      25.8602   -55.1454     
1 1 1 7  2  2  o 0 17.5882  0.286713  -2.45689     -4.31435     3.16649      -5.90695     74.0561    153.546      26.6303   105.272      
1 1 1 7  2  3  o 0 100.508  0.662135  0.0926568    -1.02182     -6.93127     1.98611      450.679    -110.163     121.258   -74.6813     
1 1 1 7  2  4  o 0 29.5082  0.394646  2.99378      -2.0532      -1.02245     3.03787      72.2568    40.3872      80.6091   -159.13      
1 1 1 7  2  5  o 0 72.6332  0.330386  1.15357      -0.980463    -0.244324    0.812657     299.925    -75.6936     43.6247   -86.7827     
1 1 1 7  2  6  o 0 79.4869  0.402494  2.52781      0.270696     -2.91976     0.254523     345.674    -81.9546     78.1883   -77.619      
1 1 1 7  2  7  o 0 60.8938  0.61102   9.73288      1.74005      -6.18029     -1.80977     239.924    -60.3869     38.9237   12.6395      
1 1 1 7  2  8  o 0 78.5108  0.351693  -0.656071    -0.0894822   -0.32912     -0.244439    298.335    -178.453     9.27552   28.4828      
1 1 1 7  2  9  o 0 24.1905  1.04699   -47.5887     9.6054       -10.1068     4.19638      104.992    158.703      80.47     98.882       
1 1 1 7  2  10 o 0 16.8753  0.816893  -29.8109     0.529899     -6.82315     0.269298     39.4819    -175.865     46.8069   -12.6375     
1 1 1 7  2  11 o 0 32.4898  0.168963  0.21443      0.802564     1.35614      0.00652792   112.954    16.7262      25.2916   -124.902     
1 1 1 7  2  12 o 0 17.9517  0.992322  -34.3876     -11.6902     -7.31322     -5.52748     72.0595    -159.705     41.5269   135.179      
1 1 1 7  2  13 o 0 20.8263  0.883891  -26.8385     9.35411      -5.39406     4.37617      70.8016    160.888      75.4029   -114.13      
1 1 1 7  2  14 o 0 24.3845  0.136822  -0.520793    -0.388597    -0.0567482   -0.144654    95.0285    -95.2338     8.46442   -129.174     
1 1 1 7  2  15 f 1 62.5189  1.20489   -19.9787     9.47681      -2.95733     4.2713       229.23     171.586      30.5165   -6.29327     
1 1 1 7  2  16 o 0 16.5052  0.531474  -20.0778     -4.33805     -7.24805     -3.48273     75.9239    154.595      53.5453   -153.001     
1 1 1 7  2  17 o 0 13.7264  0.264709  -0.157455    0.653341     0.0649172    0.0430831    31.1554    50.3595      38.4105   -150.203     
1 1 1 7  2  18 o 0 16.8669  0.742997  28.9158      10.636       -7.991       -6.5689      52.5308    56.8534      26.0929   -173.846     
1 1 1 7  2  19 o 0 7.7083   1.07309   63.2015      -6.24112     -17.6116     3.60407      37.4332    -3.51048     22.4925   -8.82224     
1 1 1 7  2  20 o 0 21.4431  0.127686  -0.253297    -0.343514    1.34548      0.625869     89.1342    -164.056     5.69647   -172.628     
1 1 1 7  2  21 o 0 2.80305  0.279311  -0.535833    0.308192     -1.2756      0.911281     12.3627    139.23       27.7573   125.485      
1 1 1 7  2  22 o 0 5.76694  0.806388  -5.03856     0.38965      -1.4709      0.35894      19.9847    -173.661     8.18649   108.154      
1 1 1 7  3  0  o 0 30.6594  0.242694  2.31575e-18  0.00756381   0            0            48.1127    -90          35.4118   -90          
1 1 1 7  3  1  o 0 45.6895  1.2878    -4.9863      23.383       9.37361      3.89179      228.503    55.9855      121.238   32.3253      
1 1 1 7  3  2  o 0 51.8364  1.36565   -6.9363      22.8928      9.31472      5.7265       219.234    162.155      31.903    -178.936     
1 1 1 7  3  3  o 0 43.1452  0.342455  5.32668      1.02026      -1.42039     -0.645276    144.187    16.9835      31.3808   -158.659     
1 1 1 7  3  4  o 0 40.6434  0.788715  -5.53046     -14.9243     4.13971      -3.3646      125.519    -72.0085     93.9537   169.313      
1 1 1 7  3  5  o 0 38.6403  1.21378   -5.63611     -28.17       9.39254      -4.1257      139.506    -143.667     20.0742   87.1859      
1 1 1 7  3  6  o 0 35.4314  0.769503  -9.35511     7.03708      -0.98638     3.01501      147.979    113.795      44.5962   156.636      
1 1 1 7  3  7  o 0 82.7768  0.784246  0.437906     -8.33542     4.05757      -0.0181766   307.425    -153.716     29.0586   -15.3369     
1 1 1 7  3  8  o 0 105.818  0.467175  1.99042      4.18824      1.63726      -1.1978      425.843    -33.2017     68.6549   22.0074      
1 1 1 7  3  9  o 0 18.3774  0.38241   -1.44273     6.56271      2.05313      0.920234     62.9078    89.3812      16.1792   163.254      
1 1 1 7  3  10 o 0 59.503   0.62606   -2.51387     -1.73167     -0.415335    -0.936404    225.052    152.099      18.5704   -103.211     
1 1 1 7  3  11 o 0 22.3167  0.134047  -0.266119    2.74833      16.742       0.418967     107.948    -8.76238     64.9285   -48.4326     
1 1 1 7  3  12 o 0 37.4165  0.187605  -0.0342471   1.16431      0.92439      -0.125866    108.213    -179.86      70.5163   24.9082      
1 1 1 7  3  13 o 0 51.7201  1.03638   1.5011       21.5279      3.64518      -0.694285    181.452    75.8418      32.8345   -141.721     
1 1 1 7  3  14 f 1 62.9762  0.720505  2.54981      6.86792      1.16355      -1.23153     285.976    71.0374      77.8337   72.6498      
1 1 1 7  3  15 f 1 5.96494  0.213885  0.663724     7.19532      5.37182      -0.922243    6.07926    160.958      16.1829   -77.6716     
1 1 1 7  3  16 o 0 23.5815  0.759424  -16.0704     -9.2777      -2.0109      -3.79409     85.9242    -166.343     11.7151   -40.0238     
1 1 1 7  3  17 o 0 20.4709  0.968758  2.79857      -51.2835     20.2031      1.86032      69.7236    -125.426     41.4719   -19.7338     
1 1 1 7  3  18 o 0 41.0473  0.195802  0.202063     1.1895       1.44447      0.306792     145.701    10.9061      18.2496   -178.316     
1 1 1 7  3  19 o 0 16.5112  0.252712  -1.94674     3.50466      1.03302      2.28621      64.2572    56.1074      8.7063    179.73       
1 1 1 7  3  20 o 0 48.1977  0.68632   6.48094      10.1511      2.39257      -3.10939     222.152    14.5327      52.233    16.6781      
1 1 1 7  3  21 o 0 18.1495  0.439627  0.411019     2.62986      1.15742      -1.22485     53.867     133.644      36.4157   -51.1365     
1 1 1 7  3  22 o 0 13.8987  0.612452  -0.937858    -1.49634     0.0890015    -0.318641    56.2795    -112.024     6.8169    -113.14      
1 1 1 7  4  0  o 0 3.82099  0.186914  6.26335e-18  0.0204577    0            0            3.40544    90           46.7318   -90          
1 1 1 7  4  1  o 0 62.506   0.530062  -0.0941686   0.46329      0.388071     -4.07539     267.871    119.599      109.643   163.858      
1 1 1 7  4  2  o 0 27.4981  0.97706   -22.642      -6.07128     -4.62949     -2.74015     127.495    -170.404     64.8236   -146.179     
1 1 1 7  4  3  o 0 38.6769  0.880944  14.8225      -3.15574     -5.69217     2.75051      130.229    33.8587      72.6836   -73.1594     
1 1 1 7  4  4  o 0 108.455  1.14006   -8.01746     1.7028       -2.83849     1.88398      424.731    -139.701     23.2224   -147.376     
1 1 1 7  4  5  o 0 18.2254  0.103828  -0.165258    1.30856      0.948559     0.234871     59.4121    37.8812      5.92656   134.844      
1 1 1 7  4  6  o 0 30.1878  0.201987  22.8088      -2.95597     -36.6274     8.7036       148.948    -68.0145     117.328   -22.3016     
1 1 1 7  4  7  o 0 88.4957  0.40903   3.84799      1.74311      -0.663612    -1.01597     409.41     -36.0658     143.984   -29.6076     
1 1 1 7  4  8  f 1 78.5945  0.652103  -1.93517     0.761208     -0.473486    0.622874     372.165    92.3795      140.218   94.8442      
1 1 1 7  4  9  o 0 21.075   0.121425  0.494735     -0.378209    -0.0717525   0.295989     55.0942    -5.8581      32.8057   168.936      
1 1 1 7  4  10 o 0 43.5517  1.1599    -40.412      -1.8786      -9.81161     -1.13413     110.377    -160.62      117.094   39.915       
1 1 1 7  4  11 o 0 39.4537  0.424271  0.886107     2.62202      1.23222      -1.46755     96.8869    6.4265       106.171   -162.998     
1 1 1 7  4  12 o 0 11.5627  0.220021  -13.3807     2.85879      -19.8762     8.42845      57.7885    158.697      122.577   -158.283     
1 1 1 7  4  13 o 0 39.2239  0.19114   -0.597257    1.79249      0.311049     0.385211     170.989    56.5292      52.8257   64.5883      
1 1 1 7  4  14 o 0 51.9481  0.23949   0.015432     0.798742     0.0997431    0.0144826    218.571    15.376       33.5289   25.9413      
1 1 1 7  4  15 o 0 29.7811  0.729002  -1.56453     12.1201      2.21506      0.696593     103.388    97.6243      22.3411   -76.2948     
1 1 1 7  4  16 o 0 10.6891  1.31269   -83.2171     10.0439      -21.6015     5.41513      18.6873    -162.542     51.4649   -38.6236     
1 1 1 7  4  17 o 0 34.1318  0.175902  -0.0440574   -0.177573    0.460717     0.0447325    146.678    8.97277      36.7655   5.44404      
1 1 1 7  4  18 o 0 23.8527  1.2756    71.5948      1.25775      -17.3221     -0.877764    77.957     -6.88046     21.753    165.033      
1 1 1 7  4  19 o 0 24.3958  0.14961   0.355742     -0.184719    -0.574958    -0.0641875   107.878    -47.7401     19.8429   -66.303      
1 1 1 7  4  20 o 0 19.4291  0.403984  1.92952      -2.34499     0.283241     0.875848     90.2035    -62.7037     26.5188   -61.183      
1 1 1 7  4  21 o 0 8.92031  0.315947  -1.2163      1.06251      0.114484     0.729083     35.3996    176.651      6.73329   -169.749     
1 1 1 7  5  0  o 0 9.21955  0.112507  1.60412e-18  0.00523947   0            0            7.88668    90           13.3616   -90          
1 1 1 7  5  1  o 0 57.6297  2.34115   6.42778      -61.1594     16.4513      3.17256      203.554    -97.931      20.7021   63.5315      
1 1 1 7  5  2  o 0 67.6173  0.642519  2.44677      -2.04836     0.025068     1.76768      260.412    -28.6726     22.299    12.1059      
1 1 1 7  5  3  o 0 40.3031  0.193003  0.0154153    0.170088     0.288017     -0.240998    169.913    176.985      47.4859   163.758      
1 1 1 7  5  4  o 0 51.8373  0.240359  -0.191874    -0.131521    -0.39957     -0.357765    250.655    8.80757      120.92    5.9898       
1 1 1 7  5  5  o 0 12.432   0.658442  4.33921      70.8375      62.2934      -7.89648     37.8912    -168.859     46.5982   -93.5217     
1 1 1 7  5  6  o 0 42.0752  0.239041  -1.9367      0.618916     -2.40831     2.65582      106.845    72.2767      135.173   -57.0521     
1 1 1 7  5  7  o 0 100.183  0.825096  2.29547      8.37436      3.66632      -3.21629     426.358    33.796       86.1883   15.477       
1 1 1 7  5  8  o 0 40.2837  0.246778  0.0613432    -0.380982    0.363686     0.0312388    143.819    -126.562     15.1964   86.8703      
1 1 1 7  5  9  o 0 57.4163  0.287064  -1.50106     7.04503      2.10614      1.14995      202.277    42.3619      43.0534   -175.104     
1 1 1 7  5  10 o 0 33.1793  0.51107   1.73396      -5.47841     1.79793      1.14825      142.13     -35.5794     37.5537   -28.0829     
1 1 1 7  5  11 o 0 11.9961  0.851137  -7.35255     -57.3661     28.24        -7.52555     30.3306    131.968      91.6443   63.8849      
1 1 1 7  5  12 o 0 68.5169  0.339136  -0.646095    -0.676302    -0.000746188 -0.0366909   260.555    -72.1573     7.38486   -117.764     
1 1 1 7  5  13 o 0 36.4979  0.982281  10.4718      26.628       4.00358      -3.54311     140.209    80.4043      55.3254   -7.95211     
1 1 1 7  5  14 f 1 39.0794  0.322141  -0.676125    3.73536      2.08441      0.489206     172.307    33.0264      41.5031   34.673       
1 1 1 7  5  15 o 0 28.0391  0.151445  -0.699463    2.10219      6.61793      1.89931      133.738    -175.733     57.563    162.137      
1 1 1 7  5  16 o 0 20.8061  0.443268  6.87009      -2.37735     -2.3251      1.593        67.2385    -51.3758     23.9337   163.372      
1 1 1 7  5  17 o 0 23.9115  1.59298   -19.1351     -100.047     25.8311      -9.84443     111.008    -120.041     56.9714   -83.3506     
1 1 1 7  5  18 o 0 44.6807  0.218728  0.271623     -0.170546    -0.328084    -0.768246    207.186    -37.4187     81.5229   -39.48       
1 1 1 7  5  19 o 0 11.9641  0.419984  -0.141968    5.02315      1.67067      -0.00668462  44.0577    115.21       3.28877   -94.6936     
1 1 1 7  5  20 o 0 15.7181  0.160457  0.347573     0.189767     -0.11723     0.0626335    72.2815    -67.7873     22.642    -64.874      
1 1 1 7  5  21 o 0 22.9577  1.20475   -2.67674     -8.85949     1.58572      -1.69125     89.5489    -77.0517     2.76423   154.886      
1 1 1 7  6  0  f 1 49.1203  0.304497  -5.92941e-17 -0.322782    0            0            184.374    90           22.6449   -90          
1 1 1 7  6  1  o 0 54.9235  0.708173  1.35115      -10.3744     3.32482      0.728061     166.966    -40.7307     75.517    149.437      
1 1 1 7  6  2  o 0 66.2766  1.08775   -18.9652     3.08189      -5.52245     2.09355      255.977    155.882      18.0673   144.911      
1 1 1 7  6  3  o 0 39.2122  0.187257  -2.70562     0.387501     -1.31069     0.310376     137.145    -122.922     23.8237   109.418      
1 1 1 7  6  4  f 1 94.1595  1.28215   -31.776      5.38387      -6.69563     1.99777      410.823    137.816      119.929   160.91       
1 1 1 7  6  5  o 0 33.7199  0.510169  -11.313      -7.79156     -0.899187    -2.43046     41.5805    -143.673     169.668   21.4419      
1 1 1 7  6  6  o 0 33.4936  1.71454   -132.897     12.1925      -37.0102     6.66421      137.539    -170.878     53.5084   128.476      
1 1 1 7  6  7  o 0 87.9394  0.447724  2.95563      -3.16262     -0.0457019   0.990237     404.224    -26.1037     136.48    -27.6346     
1 1 1 7  6  8  o 0 59.3065  0.372157  -3.13396     4.63863      0.351037     1.04563      214.19     68.388       34.7591   -158.279     
1 1 1 7  6  9  o 0 18.0861  0.893702  41.6805      -6.86553     -11.4702     3.78589      50.3983    -13.8922     59.5368   97.3332      
1 1 1 7  6  10 o 0 18.9955  1.37266   -69.0025     -15.921      -16.628      -7.97527     81.0521    -165.025     24.6582   -158.744     
1 1 1 7  6  11 f 1 15.3528  0.464454  6.57125      3.74627      -0.663843    -1.15883     41.1016    28.9316      26.444    -146.266     
1 1 1 7  6  12 o 0 16.7439  0.7974    -50.146      21.5904      -16.9236     18.3183      73.2657    -140.964     24.0086   -95.9908     
1 1 1 7  6  13 f 1 19.1255  0.966407  -45.6806     3.63792      -10.7032     1.60592      62.3341    170.978      30.3511   44.7882      
1 1 1 7  6  14 o 0 7.49383  0.385892  2.30789      5.71303      1.02563      -1.01411     27.5772    64.3629      16.2548   -0.441854    
1 1 1 7  6  15 o 0 16.3699  0.717147  -23.9032     -5.32964     -6.73009     -3.30585     39.5109    166.529      46.7506   -37.4914     
1 1 1 7  6  16 f 1 6.19805  0.926588  -54.7662     8.97618      -18.9761     6.28245      5.16213    27.5985      43.538    -12.6429     
1 1 1 7  6  17 o 0 18.7069  0.49523   4.04833      -8.79983     1.247        1.5213       87.4555    -97.676      42.9518   -72.7718     
1 1 1 7  6  18 o 0 19.5691  1.07234   -23.3944     3.31612      -6.01696     1.47345      91.4039    149.31       26.1893   163.796      
1 1 1 7  6  19 o 0 24.563   0.393192  -4.54576     1.38527      -1.48522     1.4423       107.81     -144.41      18.848    -149.645     
1 1 1 7  6  20 f 1 13.5144  0.485075  -0.935959    -0.084245    -0.160434    0.021614     31.4343    -134.601     42.705    52.8638      
1 1 1 7  6  21 f 1 10.085   0.144687  -0.0916241   -0.381694    0.0537122    -0.350476    30.8679    144.544      13.8614   -55.6558     
1 1 1 7  7  0  o 0 24.3783  0.173102  -8.60215e-18 -0.0468279   0            0            86.42      -90          25.8666   -90          
1 1 1 7  7  1  f 1 77.6942  2.08556   3.44698      -60.0888     13.6097      1.9112       277.471    -89.4078     27.4058   100.729      
1 1 1 7  7  2  o 0 44.4571  0.753823  -7.96351     -18.2937     5.78144      -6.49679     138.695    -166.67      90.3425   74.8125      
1 1 1 7  7  3  f 1 46.8484  0.210837  0.559623     -0.574739    0.267244     0.928393     176.167    -0.678815    23.73     72.5466      
1 1 1 7  7  4  o 0 40.8825  1.03367   -2.22934     46.1985      10.9796      1.17118      190.193    88.4701      76.0022   93.099       
1 1 1 7  7  5  o 0 59.8351  0.421887  -1.55601     27.2928      17.644       2.71767      238.352    31.3584      73.6165   102.186      
1 1 1 7  7  6  o 0 29.5707  0.14567   -2.48494     -0.786274    -1.08314     -0.819754    57.801     -104.293     108.206   97.4263      
1 1 1 7  7  7  o 0 10.7829  0.665772  -15.7077     -27.8129     7.44377      -12.5626     51.9317    -98.0785     51.1523   -109.039     
1 1 1 7  7  8  f 1 24.5888  1.52368   -21.8004     -91.9421     21.173       -10.4637     101.605    -102.509     38.6254   -156.213     
1 1 1 7  7  9  o 0 28.5493  0.387547  -2.71172     4.64515      1.90705      3.06696      121.51     107.501      67.3838   101.845      
1 1 1 7  7  10 o 0 19.9264  1.22069   -7.44926     -58.1639     13.0155      -3.30319     126.424    -98.156      108.956   -91.8202     
1 1 1 7  7  11 o 0 36.5722  1.17086   -3.05808     -46.5693     10.9352      -1.19102     155.947    -109.542     43.1356   -60.318      
1 1 1 7  7  12 f 1 14.36    0.109388  0.792546     4.31719      6.21638      -1.95429     69.1657    -36.2353     99.2897   -87.7613     
1 1 1 7  7  13 o 0 40.6966  0.600684  4.9805       6.03934      0.268277     -1.85344     135.593    106.628      50.7676   -41.8779     
1 1 1 7  7  14 o 0 21.5164  0.215924  -0.0459561   -9.2146      23.5739      -2.88832     107.099    -8.17638     48.5892   -4.19848     
1 1 1 7  7  15 o 0 29.2678  0.79369   9.73838      -14.4717     2.12752      4.56062      88.9371    -31.1834     43.4931   143.394      
1 1 1 7  7  16 o 0 43.8251  0.284238  -1.94251     5.24607      1.32439      1.51752      169.146    156.831      7.80748   153.677      
1 1 1 7  7  17 o 0 36.0342  0.692411  6.40282      24.8096      8.31341      -4.01368     117.136    28.0895      35.2632   -165.404     
1 1 1 7  7  18 o 0 15.1316  0.671185  -7.19734     -13.7459     2.95339      -3.87656     58.1098    -106.541     2.06831   132.726      
1 1 1 7  7  19 o 0 25.2212  0.204283  0.956415     0.312854     0.0596061    -0.339888    109.554    57.3125      18.0158   50.5567      
1 1 1 7  7  20 o 0 2.98333  0.337403  -0.0725352   0.335125     1.0005       -0.186115    3.34129    91.9262      7.89739   34.9835      
1 1 1 7  8  0  f 1 40.4796  0.255304  5.1237e-17   0.167353     0            0            153.886    90           90.9441   90           
1 1 1 7  8  1  o 0 60.4258  0.758376  15.7995      -9.40579     -3.15199     5.39842      217.387    -76.2873     38.457    47.8379      
1 1 1 7  8  2  o 0 25.3904  0.967804  -32.076      15.5637      -4.30239     5.38999      82.8544    167.425      78.0746   -97.812      
1 1 1 7  8  3  o 0 34.3061  1.45643   -105.67      17.8548      -33.8191     11.9906      144.253    -159.242     64.2095   141.823      
1 1 1 7  8  4  f 1 20.0519  0.874421  -29.3852     -2.71247     -7.99952     -1.41243     111.892    -176.01      89.0266   -162.548     
1 1 1 7  8  5  o 0 13.0008  0.234429  -7.67973     -2.23833     -6.39829     -3.87311     32.9867    170.831      77.3091   -103.187     
1 1 1 7  8  6  o 0 58.179   0.402308  -3.04949     -0.619658    -5.34235     -0.472121    178.408    -97.1722     86.8292   75.6815      
1 1 1 7  8  7  o 0 45.6274  0.257871  -14.3164     3.73651      -11.1718     5.31847      147.844    -121.423     52.4223   73.1036      
1 1 1 7  8  8  o 0 4.48317  0.120791  -0.180555    1.5739       1.71183      0.37602      18.669     44.1281      44.9926   24.8541      
1 1 1 7  8  9  f 1 24.5031  1.99396   -194.643     25.2805      -49.5109     12.7327      101.594    170.419      66.934    107.9        
1 1 1 7  8  10 o 0 43.7913  0.268061  2.29501      3.1113       -0.00445208  -4.76548     167.168    123.595      9.74886   -45.771      
1 1 1 7  8  11 o 0 13.1118  0.294064  3.85255      -3.5845      -0.0654031   1.61715      33.316     -31.0833     26.2327   176.667      
1 1 1 7  8  12 o 0 51.3249  0.352718  3.41513      -2.38358     -0.125545    1.32973      204.267    -72.7939     9.41689   -65.313      
1 1 1 7  8  13 f 1 18.7165  0.743887  54.0916      -5.39257     -29.7554     5.42499      89.8557    74.0003      64.921    121.872      
1 1 1 7  8  14 o 0 22.0838  0.365564  2.32912      9.53624      2.37158      -1.13617     103.017    99.6248      43.0447   92.1476      
1 1 1 7  8  15 f 1 27.8438  0.624116  36.2182      -2.70179     -16.6348     1.84842      141.598    53.1539      77.6473   69.3751      
1 1 1 7  8  16 o 0 27.8559  0.269822  -3.15588     -0.93723     -2.22847     -1.02764     87.0334    -89.4273     35.6772   111.865      
1 1 1 7  8  17 o 0 19.7401  0.448332  3.02636      -2.18353     -0.237986    1.40858      75.8548    -64.2034     6.46153   130.305      
1 1 1 7  8  18 o 0 9.68522  0.180792  2.66526      -0.898644    -1.05211     0.692276     36.6334    -57.2687     3.60643   -131.828     
1 1 1 7  8  19 o 0 14.4787  0.561452  -6.68386     2.08468      -2.87461     1.19764      58.8599    -147.81      6.34896   -115.604     
1 1 1 7  9  0  o 0 29.2951  0.203396  4.09251e-17  0.133671     0            0            112.102    -90          21.8205   -90          
1 1 1 7  9  1  o 0 49.8253  0.553842  0.0470936    -9.37816     2.84641      -0.134994    176.843    -55.4078     23.7219   125.818      
1 1 1 7  9  2  o 0 30.3268  0.932115  6.98394      58.5093      29.334       -7.57713     188.755    133.753      160.341   115.185      
1 1 1 7  9  3  o 0 73.9319  0.326868  -1.13672     0.0534411    -0.424382    0.263396     276.411    62.8207      14.0381   -159.607     
1 1 1 7  9  4  o 0 27.5456  0.138506  -0.459505    -8.48038     29.9316      -0.433042    146.309    4.77067      94.9651   29.4211      
1 1 1 7  9  5  f 1 8.77374  0.496338  -7.5329      8.46149      0.382844     3.08025      28.5451    -63.0133     116.931   -57.8792     
1 1 1 7  9  6  o 0 18.7563  0.116965  0.0787956    -0.686576    1.29249      0.0885409    57.8065    -161.331     40.9245   91.724       
1 1 1 7  9  7  o 0 50.7598  0.24574   -3.24525     -0.224944    -0.497809    -0.140146    227.058    170.895      73.5263   172.054      
1 1 1 7  9  8  o 0 11.5943  1.13375   27.7932      153.743      69.5932      -25.6602     34.0572    14.0832      20.8133   -126.559     
1 1 1 7  9  9  o 0 13.6159  0.330787  -10.7525     1.06963      -3.63844     0.689422     34.4516    -173.946     25.8305   24.1122      
1 1 1 7  9  10 o 0 47.5022  1.3977    10.3056      49.6953      12.9464      -5.08702     175.553    58.4863      20.989    -96.4005     
1 1 1 7  9  11 o 0 18.7418  0.15932   -1.16774     -0.838507    -0.211897    -0.989703    79.8119    166.958      21.7062   145.345      
1 1 1 7  9  12 o 0 43.8066  0.362259  -1.34342     8.39076      6.88439      1.10923      185.057    171.039      35.6623   145.013      
1 1 1 7  9  13 o 0 17.8334  0.442444  -5.41826     2.67282      -0.791831    1.07355      43.9422    152.471      44.734    -29.8415     
1 1 1 7  9  14 o 0 49.0608  0.32427   -1.84036     4.07878      22.8716      1.15845      168.006    178.822      37.4963   1.84758      
1 1 1 7  9  15 o 0 23.6241  0.145768  4.79022      0.120473     -3.34349     -0.626568    98.8375    -69.4269     26.1061   -37.7292     
1 1 1 7  9  16 o 0 36.7267  0.724354  -1.94502     -9.27665     1.23699      -0.392102    160.257    -91.9073     19.9649   -106.525     
1 1 1 7  9  17 o 0 2.2928   0.296361  0.0210501    -0.0158869   -0.000650803 0.00341438   13.0132    179.668      30.3327   179.33       
1 1 1 7  9  18 o 0 3.03008  0.468725  0.638539     2.78081      1.26545      -0.479868    9.68887    179.399      35.7291   -161.263     
1 1 1 7  9  19 o 0 6.8775   0.285936  -0.0628718   0.118928     0            0            19.037     -71.2173     0.594763  146.52       
1 1 1 7  10 0  o 0 45.2891  0.274338  6.36575e-18  0.0207921    0            0            173.576    -90          55.7987   -90          
1 1 1 7  10 1  o 0 11.2027  0.587114  -27.1439     7.51213      -12.1086     7.14769      31.3505    111.012      18.9604   -83.4897     
1 1 1 7  10 2  o 0 18.1794  0.257965  0.87891      3.92092      0.926579     -0.466279    55.4759    91.5462      18.4819   -67.0599     
1 1 1 7  10 3  o 0 23.1676  0.187908  -12.2599     2.28343      -41.2871     12.874       131.328    83.8622      86.1915   80.2345      
1 1 1 7  10 4  o 0 7.1699   0.260967  -2.32933     4.61661      1.56016      2.07046      46.5358    87.4727      106.064   60.2066      
1 1 1 7  10 5  o 0 6.34472  0.0822934 -2.3035      -0.281608    -10.806      -3.45878     20.0613    -41.3898     80.4037   -60.3401     
1 1 1 7  10 6  o 0 3.51994  0.254741  -7.308       2.13645      -3.89525     2.52934      27.2054    121.78       52.7285   106.739      
1 1 1 7  10 7  o 0 42.14    1.32803   -55.8574     -0.158395    -17.2335     0.382708     198.871    -146.809     66.8486   -140.998     
1 1 1 7  10 8  o 0 23.453   0.325351  4.22339      7.88372      1.50286      -2.1172      96.3382    36.7041      17.932    61.186       
1 1 1 7  10 9  o 0 18.0806  0.841701  94.6106      -5.29321     -57.2459     5.83823      64.7374    48.4193      37.298    -53.9487     
1 1 1 7  10 10 o 0 24.6742  0.142135  5.81239      -4.05532     -1.81276     7.00303      118.154    36.3695      58.8199   1.40381      
1 1 1 7  10 11 o 0 19.0787  0.338402  2.09029      -6.15182     2.4754       2.2591       81.0573    -18.3999     23.8749   14.62        
1 1 1 7  10 12 o 0 13.2965  0.318931  -10.3382     -0.158289    -7.51461     -0.479611    19.2189    85.1222      70.4945   -48.8114     
1 1 1 7  10 13 o 0 23.6742  1.6995    115.939      9.27845      -29.7179     -4.41572     95.5368    14.6281      60.0406   -55.1423     
1 1 1 7  10 14 f 1 54.1887  0.277679  -0.908984    3.49436      1.32916      0.308322     229.972    125.265      51.219    128.258      
1 1 1 7  10 15 o 0 11.9979  1.12968   32.1564      -1.94343     -10.2942     1.49883      21.0074    25.4384      55.8598   -141.516     
1 1 1 7  10 16 o 0 18.7917  0.748887  9.94467      -6.30354     -1.25114     2.32817      72.6489    -37.6755     4.70391   150.425      
1 1 1 7  10 17 f 1 14.7309  0.220688  -0.141018    -0.236597    0            0            39.8716    -141.901     36.3299   36.0973      
1 1 1 7  10 18 o 0 11.0725  0.242973  0.0764473    -0.0895599   0            0            47.3955    -85.3154     13.8411   -82.5474     
1 1 1 7  11 0  o 0 22.2666  0.158302  -2.34091e-17 -0.127433    0            0            85.2964    -90          8.09681   -90          
1 1 1 7  11 1  o 0 43.3551  0.192356  1.4579       -3.20691     4.56867      3.00114      142.743    -153.47      43.7416   31.9044      
1 1 1 7  11 2  o 0 33.2702  1.62411   -3.10075     -105.672     24.2211      -1.72259     147.279    -88.0091     46.3042   -103.004     
1 1 1 7  11 3  o 0 20.2797  0.509866  -10.3944     -2.49642     -2.41091     -1.29102     91.8276    -157.815     34.9128   -175.275     
1 1 1 7  11 4  o 0 4.1655   0.696895  1.34064      49.9499      24.9596      -1.26449     16.2331    178.016      48.0529   -161.158     
1 1 1 7  11 5  o 0 21.5006  1.2361    -24.8454     -79.8267     16.3671      -11.0867     87.9699    -105.542     33.1615   -36.2481     
1 1 1 7  11 6  o 0 23.6468  0.118087  0.752178     -0.697803    -0.680555    1.36721      56.2212    48.2228      100.799   -69.2173     
1 1 1 7  11 7  o 0 51.1516  0.616556  -1.38037     16.869       6.72522      0.569856     216.569    128.464      34.1628   154.775      
1 1 1 7  11 8  o 0 23.4083  1.50824   4.57364      90.1007      25.2944      -2.91203     100.032    104.054      22.752    125.241      
1 1 1 7  11 9  o 0 8.74081  0.610374  14.8414      14.0492      -0.285893    -6.55222     43.2492    34.5183      30.7367   55.1944      
1 1 1 7  11 10 o 0 28.0338  0.743686  8.51395      33.3336      10.6543      -6.22128     121.492    118.684      29.2118   137.115      
1 1 1 7  11 11 o 0 28.4117  0.377005  2.64994      9.57577      20.6906      -8.24678     96.3437    1.72602      39.4811   128.308      
1 1 1 7  11 12 o 0 9.14149  0.928815  20.792       -32.8103     3.7624       7.84521      67.6549    -58.7458     71.1628   -68.2106     
1 1 1 7  11 13 o 0 23.886   0.479959  7.7548       -15.9609     3.7897       4.44983      113.016    -15.0021     56.6831   -44.6625     
1 1 1 7  11 14 o 0 30.0314  0.402031  -1.19641     11.051       9.56598      4.20619      137.002    176.542      30.9891   145.263      
1 1 1 7  11 15 o 0 20.5092  0.554223  4.00078      8.2365       2.13049      -3.26488     101.893    21.1545      40.7735   11.6476      
1 1 1 7  11 16 o 0 13.9431  0.298007  -0.291987    -1.12354     0.20301      -0.400628    45.5428    -42.0133     20.9365   167.019      
1 1 1 7  11 17 o 0 32.7429  0.435486  -1.26752     -0.0620268   0            0            124.416    -150.772     12.6807   39.6858      
1 1 1 7  12 0  o 0 10.8812  0.118182  -1.95205e-17 -0.106265    0            0            34.456     90           19.5631   -90          
1 1 1 7  12 1  o 0 27.1501  0.565621  -12.4115     0.625255     -3.09753     0.402012     99.4642    -171.239     12.0907   25.164       
1 1 1 7  12 2  o 0 16.611   0.692275  -26.863      -10.5409     -5.65465     -5.14662     100.623    -159.018     80.6196   -153.985     
1 1 1 7  12 3  o 0 30.5127  0.430367  -18.7505     2.33064      -12.9253     3.9393       108.443    -116.6       36.0112   16.0937      
1 1 1 7  12 4  o 0 19.0842  1.0926    58.8852      -33.2741     -9.46275     16.0575      61.5307    -24.3491     74.7933   -120.387     
1 1 1 7  12 5  o 0 27.9635  0.668436  13.2115      -3.05677     -3.06458     1.36173      103.775    -28.5662     11.0351   143.229      
1 1 1 7  12 6  o 0 11.0742  1.62828   -133.756     7.98266      -37.321      4.29334      16.4878    168.51       49.9202   -16.8046     
1 1 1 7  12 7  o 0 20.8514  0.255793  6.35216      3.76213      -2.24558     -3.57663     83.8197    -33.5155     24.3431   37.4194      
1 1 1 7  12 8  o 0 24.0985  0.281826  4.75788      3.81261      -0.887034    -2.9096      83.9785    2.9834       22.9586   -127.417     
1 1 1 7  12 9  o 0 31.2653  0.278465  -8.92998     0.670625     -10.2661     0.173688     112.849    101.139      24.0957   -28.059      
1 1 1 7  12 10 o 0 3.83477  0.594219  -27.0146     4.30874      -13.9565     4.67123      34.4591    164.577      58.4721   150.419      
1 1 1 7  12 11 o 0 13.5219  0.19139   3.4997       -9.85541     5.2861       3.91966      28.4236    -11.4572     46.1889   -176.028     
1 1 1 7  12 12 o 0 28.0684  0.474741  17.8851      -1.41136     -26.2479     1.61856      105.469    -79.4271     14.3882   15.1088      
1 1 1 7  12 13 o 0 13.5888  0.331117  -6.84172     -4.47241     -2.19026     -4.1868      63.7019    149.354      23.7401   112.767      
1 1 1 7  12 14 o 0 13.6308  0.199211  -0.359406    1.39487      0.559968     0.453012     54.6602    34.5138      8.74055   115.896      
1 1 1 7  12 15 o 0 5.38834  0.784695  4.22767      -0.416911    -0.999268    0.128696     16.3259    -16.2037     22.3701   -101.309     
1 1 1 7  12 16 f 1 22.3473  0.475301  0.0888878    1.24163      0            0            91.9115    77.9692      6.62415   86.3467      
1 1 1 7  13 0  o 0 22.8079  0.18052   3.80641e-18  0.0124327    0            0            91.8659    90           5.20034   -90          
1 1 1 7  13 1  o 0 23.4517  1.42655   -15.8448     71.3401      20.1315      9.03568      50.9831    139.039      87.1825   -62.2327     
1 1 1 7  13 2  o 0 32.0403  0.151322  0.548725     -1.78455     0.321228     0.28913      132.546    -135.841     15.0308   -102.044     
1 1 1 7  13 3  o 0 13.6756  0.632229  9.28186      3.81335      -1.04592     -1.06028     80.7174    10.3005      73.3868   38.7195      
1 1 1 7  13 4  o 0 13.4434  0.255556  2.06243      4.86624      1.41991      -1.56438     44.2363    111.254      16.5678   -28.6877     
1 1 1 7  13 5  o 0 9.70403  0.776114  -6.51667     -62.2509     35.5857      -7.84925     52.556     -42.1227     42.1342   -48.7802     
1 1 1 7  13 6  o 0 34.1848  0.759044  -9.53309     -4.09008     -1.44495     -1.732       141.962    -129.917     20.9165   -158.78      
1 1 1 7  13 7  o 0 13.98    0.294386  -0.925476    -21.6218     26.2364      -3.20789     74.3558    -42.0442     75.0537   -86.7444     
1 1 1 7  13 8  o 0 15.3612  0.12382   0.322947     -0.261412    0.133615     1.09628      67.9983    -148.261     32.342    -111.274     
1 1 1 7  13 9  o 0 8.06767  0.310516  -3.94511     -7.92277     3.41604      -4.2804      9.74468    -95.0049     63.503    -21.2207     
1 1 1 7  13 10 f 1 16.7486  0.313298  -6.91606     -6.41043     -0.367833    -3.30929     64.8072    176.04       17.5228   -111.707     
1 1 1 7  13 11 o 0 18.2463  2.01065   -3.54704     -80.5706     23.4089      -1.54861     70.588     -107.728     16.5165   142.258      
1 1 1 7  13 12 o 0 30.6461  0.533216  4.12807      -0.613595    -2.36142     0.135568     119.427    -43.5119     19.5457   -177.537     
1 1 1 7  13 13 o 0 3.50431  1.22546   -4.04719     15.9375      1.65609      0.882472     19.4789    101.414      11.6036   93.4794      
1 1 1 7  13 14 o 0 18.4239  0.189426  -0.291893    -0.237951    -0.0104679   0.382846     69.111     -177.31      11.2762   -35.7093     
1 1 1 7  13 15 o 0 18.2258  0.303212  0.717632     -0.396084    1.54973      0.0151413    60.8501    3.23628      24.773    -153.99      
1 1 1 7  14 0  o 0 14.3283  0.131394  6.34606e-17  0.207278     0            0            57.5722    90           9.29961   -90          
1 1 1 7  14 1  o 0 25.6142  0.137818  1.04931      -0.93117     -0.532633    1.40149      116.444    -131.252     39.9369   -98.1057     
1 1 1 7  14 2  o 0 29.4661  0.550839  12.0093      1.71598      -5.17807     -1.15009     116.927    -4.85698     8.12553   -60.087      
1 1 1 7  14 3  o 0 8.82954  0.10982   0.230807     -0.0582205   -1.98902     -0.164168    11.6984    -48.904      51.6997   72.1905      
1 1 1 7  14 4  o 0 2.7406   0.986956  -17.3412     6.58129      -1.94486     1.74126      39.8517    -176.526     62.0338   -168.048     
1 1 1 7  14 5  o 0 19.0684  0.222686  1.70396      -5.58323     1.85372      1.08359      90.7863    -6.21869     50.8194   -46.7294     
1 1 1 7  14 6  f 1 32.6303  1.15818   31.7615      -1.7431      -15.4692     0.651221     110.642    -58.8565     52.0988   65.6248      
1 1 1 7  14 7  o 0 20.9627  0.304067  5.37572      -4.66046     -0.284691    4.33412      101.075    20.3631      42.2666   25.9837      
1 1 1 7  14 8  o 0 43.8436  1.26662   6.77268      0.00578766   -0.843624    -0.159273    186.965    -62.3104     41.3118   -37.34       
1 1 1 7  14 9  f 1 20.9506  0.163615  1.06283      0.630694     -0.371948    -0.374565    88.3649    33.8349      4.47496   68.1936      
1 1 1 7  14 10 o 0 15.0959  0.439189  -11.1724     -0.567303    -12.0272     -2.42611     74.9159    113.136      27.3489   139.593      
1 1 1 7  14 11 o 0 7.7326   0.318383  0.797017     -4.30876     2.62541      1.17821      25.925     -146.817     23.6222   123.546      
1 1 1 7  14 12 o 0 26.8931  0.241467  -1.79281     1.90371      -5.73941     0.0791479    125.234    92.4298      30.3143   101.46       
1 1 1 7  14 13 f 1 31.2601  0.90071   0.829017     -3.17976     0.384077     0.645696     115.028    -128.393     25.0897   33.5805      
1 1 1 7  15 0  o 0 9.29516  0.132574  1.63375e-17  0.0533625    0            0            31.4387    90           9.52586   90           
1 1 1 7  15 1  o 0 12.0768  0.500042  2.62207      -22.8559     13.4825      2.84807      63.5161    -155.488     37.2638   179.594      
1 1 1 7  15 2  o 0 21.1886  0.456318  -1.96153     -14.4859     8.6732       -1.91762     75.2377    -164.112     30.16     78.0711      
1 1 1 7  15 3  o 0 14.4459  0.151089  0.00552753   -0.0175651   -0.000614008 0.000443917  36.3064    -27.9217     37.0571   152.448      
1 1 1 7  15 4  o 0 34.6434  0.594755  3.27128      -8.43977     2.16831      2.44985      121.12     -100.92      29.2373   93.0217      
1 1 1 7  15 5  o 0 11.3521  0.966878  -0.789457    -23.9382     8.6366       -0.33616     53.6598    -120.763     22.9092   -142.802     
1 1 1 7  15 6  o 0 14.587   0.697734  5.86421      5.45458      -0.0532606   -2.37984     60.3944    3.94043      28.2208   89.4542      
1 1 1 7  15 7  o 0 14.4809  0.478912  2.35626      13.8176      7.96546      -3.41997     61.831     148.707      16.4572   -130.744     
1 1 1 7  15 8  o 0 20.4131  0.233796  1.34964      2.99032      4.98095      -2.79409     69.4982    -4.18981     37.7405   141.119      
1 1 1 7  15 9  o 0 9.73517  0.321008  -0.723205    1.6221       0.384281     0.493196     36.51      87.8011      2.06959   -81.9103     
1 1 1 7  15 10 f 1 8.13467  0.20731   1.09893      -0.64912     -0.118959    0.903567     4.00872    159.373      69.0861   120.71       
1 1 1 7  15 11 o 0 18.4741  0.415752  0.75971      4.57213      4.7873       0.887288     62.7085    18.6617      29.4396   166.438      
1 1 1 7  15 12 o 0 11.4578  0.324182  -1.21575     -0.325799    -0.454647    -1.17313     50.679     130.126      19.4871   179.135      
1 1 1 7  16 0  o 0 12.506   0.223848  -1.74453e-17 -0.0949676   0            0            55.2973    -90          37.1465   90           
1 1 1 7  16 1  f 1 20.0544  0.796299  -11.9308     3.98405      -2.59174     1.71198      100.911    177.042      31.3219   165.004      
1 1 1 7  16 2  o 0 38.6632  0.396599  0.671444     -0.928947    -0.259533    0.419579     178.996    -128.084     22.8898   -111.339     
1 1 1 7  16 3  o 0 20.6341  0.441433  -10.8111     1.09038      -8.97747     0.67457      112.325    107.033      50.5906   126.991      
1 1 1 7  16 4  o 0 9.93127  0.31918   -1.86411     -0.292804    -0.506397    -0.204258    45.1601    -159.586     17.7446   -167.756     
1 1 1 7  16 5  o 0 19.692   0.507538  -2.09246     -3.09425     0.797604     -1.21655     85.0744    -132.824     6.50953   -179.308     
1 1 1 7  16 6  o 0 9.07984  1.1131    -7.57336     1.44121      -1.80716     0.534031     38.7625    151.783      11.5169   -148.085     
1 1 1 7  16 7  o 0 7.76775  0.550977  -5.13526     1.34028      -2.13667     1.62269      36.3868    117.276      27.0674   174.17       
1 1 1 7  16 8  o 0 24.2718  0.436177  -0.958528    1.44115      -0.235877    0.718768     114.668    73.1938      27.9033   77.8231      
1 1 1 7  16 9  o 0 29.7072  0.605808  4.54278      -0.676669    -2.48945     -1.05076     109.759    -60.7509     27.1001   111.846      
1 1 1 7  17 0  o 0 5.44059  0.345022  -1.22584e-17 -0.0667319   0            0            19.8536    90           11.5965   -90          
1 1 1 7  17 1  o 0 17.7651  0.277094  -0.0278779   0.156078     0            0            80.9325    -177.293     10.5427   176.565      
1 1 1 7  17 2  o 0 21.9021  0.308383  1.20695      -0.0923334   0            0            83.5023    132.831      21.5873   -32.3072     
1 1 1 7  17 3  f 1 20.9285  0.306073  -0.0792777   0.342897     0            0            87.6899    -152.054     3.4573    67.743       
1 1 1 7  17 4  o 0 6.68581  0.347871  0.312965     0.0108001    0            0            10.6194    -35.9693     9.07605   -16.7019     
1 1 1 7  17 5  o 0 12.4499  0.236433  0.0734382    0.00390836   0            0            52.7732    -170.277     5.32403   -169.351     
1 1 1 7  17 6  o 0 16.0312  0.260829  -0.258929    0.0576942    0            0            46.6652    -145.195     39.5328   38.1707      
1 1 1 8  0  0  o 0 62.219   0.549617  -0.0980847   1.20119e-17  0            0            232.42     180          48.6346   -180         
1 1 1 8  0  1  o 0 36.465   0.253273  3.28967e-17  0.107449     0            0            137.329    -90          11.8333   90           
1 1 1 8  0  2  o 0 41.112   0.310211  -0.108276    1.326e-17    0            0            156.052    180          25.3707   -180         
1 1 1 8  0  3  o 0 177.008  1.15454   4.59649e-17  0.150133     0            0            676.577    -90          75.8496   -90          
1 1 1 8  0  4  o 0 42.8007  0.336129  0.0755963    0            0            0            164.505    0            10.6042   -5.78825e-14 
1 1 1 8  0  5  o 0 16.2388  0.164591  -1.39665e-17 -0.0760302   0            0            46.6218    -90          1.69691   90           
1 1 1 8  0  6  o 0 56.2219  0.404395  0.20721      0            0            0            217.311    0            109.643   0            
1 1 1 8  0  7  o 0 38.9102  0.330007  -1.47514e-17 -0.080303    0            0            150.388    -90          12.4315   90           
1 1 1 8  0  8  o 0 18.2757  0.149249  -0.0161613   1.97919e-18  0            0            29.4521    0            7.07457   0            
1 1 1 8  0  9  o 0 10.7889  0.12823   6.91671e-18  0.0225917    0            0            36.268     90           70.6862   -90          
1 1 1 8  0  10 o 0 59.5113  0.417982  -0.085868    1.05158e-17  0            0            230.129    180          25.6847   -180         
1 1 1 8  0  11 o 0 44.8286  0.32994   2.82512e-17  0.0922753    0            0            172.259    -90          41.5757   -90          
1 1 1 8  0  12 o 0 4.11096  0.219097  -0.000924577 1.13228e-19  0            0            3.0929     0            20.2097   180          
1 1 1 8  0  13 f 1 3.86005  0.23177   7.81063e-18  0.0255115    0            0            2.28214    -90          20.1605   90           
1 1 1 8  0  14 o 0 18.636   0.172784  -0.00649202  7.95044e-19  0            0            67.3331    0            25.6277   6.70502e-15  
1 1 1 8  0  15 o 0 8.63134  0.159235  -3.06869e-18 -0.0167052   0            0            4.30688    -90          1.17128   -90          
1 1 1 8  0  16 o 0 76.4212  0.455914  0.597399     0            0            0            294.804    0            13.6726   0            
1 1 1 8  0  17 o 0 22.7969  0.169806  -6.42929e-17 -0.349994    0            0            86.9367    -90          26.3306   90           
1 1 1 8  0  18 o 0 21.8083  0.168356  0.120079     0            0            0            82.1661    0            0.43763   180          
1 1 1 8  0  19 o 0 2.07364  0.346839  -2.16642e-18 -0.0117935   0            0            0.686177   -90          5.19202   90           
1 1 1 8  0  20 o 0 14.3388  0.16205   -0.0859077   1.05207e-17  0            0            58.2399    180          5.80718   -180         
1 1 1 8  0  21 o 0 19.0394  0.47639   8.72817e-17  0.285084     0            0            76.2807    -90          2.49052   90           
1 1 1 8  1  0  f 1 44.0193  0.332558  0.253519     0            0            0            163.573    180          69.0411   -180         
1 1 1 8  1  1  o 0 46.5467  1.29503   27.0752      5.10763      -9.0322      -3.25117     135.222    -25.1145     79.8097   -174.768     
1 1 1 8  1  2  o 0 59.3838  0.302649  1.63961      1.87084      0.486963     -1.8038      224.882    128.565      16.185    67.3264      
1 1 1 8  1  3  o 0 79.0435  0.359827  0.715072     -1.52579     0.213553     0.432058     311.979    171.429      38.1375   -149.129     
1 1 1 8  1  4  o 0 84.9593  0.796357  1.76103      -9.80327     3.09351      1.49747      316.253    -117.544     13.9431   89.5659      
1 1 1 8  1  5  f 1 113.123  1.4254    -9.6848      0.794781     -1.96337     0.501621     544.523    -167.978     225.646   -168.497     
1 1 1 8  1  6  o 0 53.9654  1.19762   -1.89402     -30.9717     7.53544      -0.815043    216.738    -100.049     26.2681   -96.6042     
1 1 1 8  1  7  o 0 53.2454  0.911891  -8.89966     -2.13286     -1.61527     -0.756591    209.425    -144.824     25.2789   167.576      
1 1 1 8  1  8  o 0 48.6119  0.575593  3.15596      3.63806      0.078525     -1.02622     159.588    87.569       57.7805   -62.8127     
1 1 1 8  1  9  o 0 13.771   0.141312  1.2816       -2.62736     2.03281      2.48089      39.686     -43.7776     51.3333   -55.6794     
1 1 1 8  1  10 o 0 18.0781  0.821968  4.66643      -25.4668     7.13481      2.61293      36.3183    -86.8817     70.5565   51.1385      
1 1 1 8  1  11 o 0 15.3496  0.300817  -5.81656     1.88642      -2.37897     1.61285      65.2366    -155.574     29.8317   -169.415     
1 1 1 8  1  12 f 1 30.5311  0.478253  4.26065      16.3788      8.14629      -4.16892     107.582    139.078      19.7503   -86.9347     
1 1 1 8  1  13 o 0 24.0785  0.490335  1.59272      -7.81576     1.23619      0.583251     92.7875    -93.9415     29.0363   -12.4709     
1 1 1 8  1  14 o 0 32.8948  0.170868  0.870445     0.212208     -0.5286      -0.379447    126.81     59.4977      8.61593   128.885      
1 1 1 8  1  15 f 1 16.4323  0.175399  -4.61465     2.79075      -1.93763     4.30851      38.9554    83.2051      52.2172   -127.667     
1 1 1 8  1  16 o 0 39.129   0.78023   0.0212132    19.6012      5.06092      -0.209052    153.899    114.062      9.86688   97.8629      
1 1 1 8  1  17 o 0 46.6351  0.227026  1.0688       -0.560405    -2.91572     0.755628     175.965    -114.587     26.6607   -25.2728     
1 1 1 8  1  18 f 1 13.8473  1.01205   9.79146      55.0855      17.1133      -6.48622     25.6819    98.3         58.9644   -39.3185     
1 1 1 8  1  19 o 0 26.5835  0.136146  -0.309645    -0.976938    0.363199     -1.07999     118.623    175.264      23.3071   160.681      
1 1 1 8  1  20 f 1 10.4846  0.127917  -0.687757    -0.0494368   -0.402651    -0.172693    46.5533    99.5383      17.8786   129.73       
1 1 1 8  1  21 o 0 10.9727  0.353001  0.168194     0.355919     0            0            41.0968    87.619       1.8961    14.5866      
1 1 1 8  2  0  o 0 52.7039  0.419762  0.155661     0            0            0            195.238    180          64.1469   -180         
1 1 1 8  2  1  o 0 38.8204  1.43085   -35.5261     8.90709      -8.44472     4.65415      151.515    -175.296     41.9411   126.956      
1 1 1 8  2  2  o 0 75.6485  0.751714  3.95523      -4.47009     0.573799     2.51799      297.055    -69.4886     33.08     -84.0138     
1 1 1 8  2  3  o 0 60.4816  0.628861  -2.94763     -10.18       2.3293       -1.3264      238.003    -107.752     26.2103   -114.479     
1 1 1 8  2  4  o 0 60.8312  0.594179  -6.29699     -4.70904     -0.615623    -3.12169     162.261    166.079      133.797   -16.3611     
1 1 1 8  2  5  o 0 76.6947  1.49963   26.0092      6.00553      -6.76892     -2.88099     334.688    -13.1089     90.17     -6.53957     
1 1 1 8  2  6  o 0 92.8834  0.428194  0.224719     -4.49998     1.95404      0.66372      374.536    -138.43      42.5039   -140.171     
1 1 1 8  2  7  o 0 8.55036  0.680594  -29.3002     24.1895      -2.34442     12.0052      14.686     -134.571     64.6693   -76.9454     
1 1 1 8  2  8  o 0 26.4964  0.713192  -18.4007     0.325001     -5.825       0.277159     81.5072    163.594      26.6074   -20.5458     
1 1 1 8  2  9  o 0 38.25    0.362492  7.48991      5.2202       -1.09896     -3.27909     135.716    -10.7065     17.8868   143.087      
1 1 1 8  2  10 o 0 56.7     0.48223   -4.07241     -2.44783     -0.684317    -1.16466     222.851    146.021      25.0961   -160.187     
1 1 1 8  2  11 o 0 20.382   0.720451  -20.4855     2.85492      -5.81603     1.70787      52.9846    -170.128     42.3324   18.4097      
1 1 1 8  2  12 o 0 48.995   0.248565  0.224948     -0.351609    0.0184821    0.0797736    228.24     -112.776     91.6598   -111.739     
1 1 1 8  2  13 o 0 36.3568  0.379941  7.4907       -6.38387     -0.883182    3.88813      133.503    -61.295      25.5852   -178.721     
1 1 1 8  2  14 o 0 25.0966  0.957966  -36.0204     -6.24281     -7.3853      -2.76252     98.9593    -171.202     9.23363   150.683      
1 1 1 8  2  15 o 0 63.9469  0.691076  -5.70225     -5.53349     0.146099     -1.22212     277.399    -93.9689     61.828    -103.48      
1 1 1 8  2  16 o 0 26.1928  0.262966  4.50972      5.15138      0.078577     -6.67597     81.6201    121.14       37.2211   -76.9919     
1 1 1 8  2  17 o 0 59.282   0.275111  -9.36057     3.79287      -5.65055     3.08723      245.056    93.1525      43.0436   104.434      
1 1 1 8  2  18 o 0 29.6705  0.520089  -10.5758     10.7963      0.390157     4.8101       113.344    115.79       7.46914   102.63       
1 1 1 8  2  19 o 0 12.484   0.89415   10.3825      -11.5305     0.460844     3.45164      35.5508    -41.2499     35.275    -174.224     
1 1 1 8  2  20 o 0 19.7275  0.266871  -3.78097     -1.33647     -3.31903     -1.81631     73.0549    -90.6099     11.5285   101.194      
1 1 1 8  2  21 o 0 4.95384  0.235811  0.201487     -0.050913    -0.596005    -0.527535    2.606      35.6035      14.8654   9.67793      
1 1 1 8  3  0  o 0 99.2366  0.57856   -0.394635    4.83289e-17  0            0            367.122    180          15.9247   -5.74887e-13 
1 1 1 8  3  1  o 0 29.5144  1.45108   -29.7856     -23.6014     -2.33615     -9.45293     116.017    -147.713     82.1116   -81.0073     
1 1 1 8  3  2  o 0 65.5736  0.937695  10.9704      5.37078      -3.54609     -3.93498     292.987    79.8842      100.268   76.574       
1 1 1 8  3  3  o 0 39.6058  1.1148    -0.722299    23.7604      6.04924      0.468643     120.073    108.07       60.0804   -37.0921     
1 1 1 8  3  4  o 0 39.3969  1.21305   23.2591      -32.5273     3.93834      11.1401      217.588    -82.2979     179.568   -52.1153     
1 1 1 8  3  5  o 0 71.9675  0.689149  -6.48983     3.83549      -0.907003    1.46496      318.646    176.239      97.4561   170.902      
1 1 1 8  3  6  o 0 66.7599  0.634033  -0.300278    -4.72864     3.54141      -0.907382    259.638    -146.169     48.8547   146.632      
1 1 1 8  3  7  o 0 94.6405  0.436509  -0.577494    -0.77035     0.596077     -0.959478    389.682    85.7602      58.4115   104.076      
1 1 1 8  3  8  o 0 65.2569  0.302856  0.513189     -0.235716    -2.29126     0.41757      295.815    96.0561      101.609   78.7077      
1 1 1 8  3  9  o 0 22.8369  0.289918  -0.398059    6.88587      12.8133      0.485392     77.9269    178.011      24.2295   -47.1027     
1 1 1 8  3  10 o 0 14.3609  0.439087  -6.86913     10.9346      3.01262      5.99037      34.2657    6.40293      99.5301   -66.7805     
1 1 1 8  3  11 f 1 36.241   0.178463  0.121117     -1.44738     0.554122     0.169733     123.149    -11.6341     25.7694   -166.007     
1 1 1 8  3  12 o 0 23.4033  0.579473  -14.0401     -11.7782     -0.870654    -5.99271     111.394    -115.781     60.1793   -120.552     
1 1 1 8  3  13 o 0 12.1955  0.577216  -1.69033     28.1264      12.6128      1.70143      61.2137    59.5418      48.9714   99.8051      
1 1 1 8  3  14 o 0 37.5276  0.404042  -7.51821     0.846286     -3.32834     0.493719     172.479    -140.424     56.1838   -134.196     
1 1 1 8  3  15 f 1 28.4011  0.997744  -6.41869     30.7616      6.55904      3.00472      111.02     95.8002      6.64767   112.069      
1 1 1 8  3  16 o 0 12.823   0.497058  0.556699     -10.5219     2.92621      0.259427     41.2796    -98.7928     12.6981   29.6853      
1 1 1 8  3  17 o 0 5.8924   0.200711  -3.5526      0.881742     -1.87189     0.934483     1.91022    69.4065      30.4196   -39.5129     
1 1 1 8  3  18 o 0 13.2075  0.875454  -23.774      -27.8415     1.29076      -8.62989     57.6408    -125.831     48.4773   179.027      
1 1 1 8  3  19 o 0 6.08522  0.772792  4.00739      15.7499      4.8641       -2.74579     39.5836    76.3459      42.075    83.0544      
1 1 1 8  3  20 o 0 10.9691  0.381987  2.25535      -0.467046    -1.03853     0.0981929    50.4256    -66.2076     19.2766   -43.1277     
1 1 1 8  3  21 o 0 24.3805  0.24218   -0.447865    -2.22523     1.48716      1.36019      103.902    -173.802     29.1431   -122.079     
1 1 1 8  4  0  o 0 31.7569  0.254588  -0.0715816   8.76622e-18  0            0            117.467    180          9.41141   -180         
1 1 1 8  4  1  o 0 45.0265  0.243101  -7.17644     4.72777      -3.96642     7.98893      155.158    70.4921      31.0065   -61.2053     
1 1 1 8  4  2  o 0 16.9564  0.519409  -33.8553     8.75652      -25.1919     14.1417      27.6423    -93.3104     82.6199   37.8955      
1 1 1 8  4  3  o 0 111.236  1.09642   -1.56356     -8.50636     3.23361      -2.02894     436.246    -32.6619     52.2853   -72.6536     
1 1 1 8  4  4  o 0 42.2921  1.3687    68.8145      10.9963      -17.242      -5.87553     101.236    6.32878      110.03    -167.362     
1 1 1 8  4  5  o 0 44.4665  1.00948   32.1422      19.3493      -3.89194     -7.57171     154.112    25.5688      24.4627   176.725      
1 1 1 8  4  6  o 0 26.2898  0.192273  -5.74813     2.80447      -1.74943     2.12559      98.1258    -166.479     17.5772   -130.236     
1 1 1 8  4  7  o 0 52.6454  0.283924  -0.919941    2.82529      3.37239      1.58724      254.256    20.0776      115.411   33.9306      
1 1 1 8  4  8  o 0 24.8126  1.33195   84.5756      -5.30765     -25.7321     3.36363      151.924    11.2931      135.586   4.85167      
1 1 1 8  4  9  o 0 79.9374  0.374819  -3.37268     -4.60311     0.692711     -1.52236     355.941    -28.32       110.489   -45.6626     
1 1 1 8  4  10 o 0 27.0385  0.562779  10.3076      -2.56953     -4.37455     2.4175       66.5299    -53.6811     78.4698   171.104      
1 1 1 8  4  11 o 0 13.4048  0.184977  -2.37573     0.666546     -0.795147    0.447303     29.7528    -174.338     66.7798   90.3292      
1 1 1 8  4  12 o 0 33.6459  0.375364  -5.41626     -2.82455     -1.12044     -1.52515     128.352    -119.598     10.7081   -127.391     
1 1 1 8  4  13 o 0 38.4462  0.299622  0.775191     4.92022      3.23783      -0.753595    151.084    13.6918      12.8664   78.5621      
1 1 1 8  4  14 o 0 25.5756  0.320787  -15.663      -0.868268    -16.5446     -0.699233    113.697    -104.557     32.1692   -124.26      
1 1 1 8  4  15 o 0 12.2535  0.468541  3.1447       12.0418      3.80972      -2.01027     44.2875    71.0308      7.87179   48.9398      
1 1 1 8  4  16 o 0 22.5291  0.680542  -19.8561     -1.09265     -5.53377     -0.430217    65.4563    165.632      36.7309   -22.2133     
1 1 1 8  4  17 f 1 41.0304  0.200537  -1.70187     2.10813      0.468378     1.00654      161.707    121.367      16.9087   124.702      
1 1 1 8  4  18 o 0 20.7768  0.695921  -12.5944     4.61338      -3.34531     2.39233      86.9766    -159.801     25.9518   173.4        
1 1 1 8  4  19 o 0 18.1295  0.950546  3.22789      -19.2989     4.29662      1.69327      83.6851    -106.293     37.6832   -59.7631     
1 1 1 8  4  20 o 0 12.5961  1.41037   13.2498      -0.3795      -3.00992     0.42178      40.5764    -3.12296     17.7915   148.752      
1 1 1 8  4  21 o 0 23.2938  0.332228  -0.280657    0.289417     0            0            82.7286    101.158      16.1722   -83.3901     
1 1 1 8  5  0  o 0 148.738  0.837688  0.0817176    0            0            0            551.417    0            26.4975   4.72573e-13  
1 1 1 8  5  1  o 0 53.678   0.252781  -2.93915     -10.1861     8.86096      -4.6477      271.312    -177.045     167.527   -152.656     
1 1 1 8  5  2  o 0 26.304   0.150069  -6.0663      -1.03536     -20.0879     -5.56902     57.4932    -85.3152     80.7367   91.5721      
1 1 1 8  5  3  o 0 126.652  1.32739   -0.0027376   16.2894      6.49336      -0.951072    480.044    152.903      44.6056   79.6074      
1 1 1 8  5  4  o 0 63.8958  1.34913   -26.446      11.8413      -3.8652      4.49514      290.903    154.544      107.78    157.013      
1 1 1 8  5  5  o 0 14.0272  0.424844  0.591867     -11.669      3.07365      0.32272      15.8567    150.429      121.027   114.003      
1 1 1 8  5  6  o 0 34.5727  0.173565  -0.00871579  0.262878     0.358377     -0.191654    164.959    16.6207      86.3364   12.5873      
1 1 1 8  5  7  o 0 27.8416  0.30767   1.6193       -13.704      15.3705      3.40657      116.599    -8.41395     23.4272   -26.4394     
1 1 1 8  5  8  f 1 42.2568  0.915748  14.4031      -8.45385     -2.29423     4.50979      120.139    -43.7249     77.1664   137.867      
1 1 1 8  5  9  o 0 58.6047  1.64611   -3.9871      -43.0645     12.0879      -2.73001     266.927    -129.229     94.3279   -117.503     
1 1 1 8  5  10 o 0 19.9663  0.273634  3.85246      0.228931     -2.45074     -0.150825    73.2521    65.4533      13.0042   142.587      
1 1 1 8  5  11 o 0 18.2954  0.80829   -22.9335     -3.72125     -4.58189     -1.44453     54.3397    -172.313     29.5629   49.8372      
1 1 1 8  5  12 o 0 24.4513  0.648425  13.3832      -12.9897     -0.24661     4.24183      114.218    -61.4057     64.0287   -19.3393     
1 1 1 8  5  13 f 1 27.0389  1.42015   9.76414      -79.0545     18.0963      4.79703      100.675    -84.5512     27.8301   179.838      
1 1 1 8  5  14 o 0 40.6402  1.13494   19.1154      -1.19328     -3.01748     0.246794     157.442    -28.6564     25.263    51.4941      
1 1 1 8  5  15 o 0 21.4296  0.234623  2.11312      10.0902      10.322       -5.2349      87.7168    153.136      12.9833   147.486      
1 1 1 8  5  16 o 0 38.9112  0.194655  -0.502922    -0.61325     0.041149     -0.420695    163.293    95.6367      36.3638   107.24       
1 1 1 8  5  17 o 0 5.67836  0.277749  0.63148      -1.312       0.0940327    0.118173     10.9422    -46.3437     25.4644   46.9366      
1 1 1 8  5  18 o 0 45.4318  0.61808   -7.16857     2.11198      -1.20936     0.574714     194.769    150.508      19.8828   153.063      
1 1 1 8  5  19 o 0 14.9803  0.877398  3.20152      22.9423      7.55693      -1.87699     62.1564    43.1585      9.01005   93.5433      
1 1 1 8  5  20 o 0 25.3462  1.4235    8.69845      1.13218      -1.47336     -0.053249    111.081    9.69824      22.8775   15.5835      
1 1 1 8  6  0  o 0 4.1833   0.17206   0.00430305   0            0            0            4.51794    180          57.5397   -4.63995e-15 
1 1 1 8  6  1  o 0 70.6157  0.556965  -0.752425    -6.22577     2.09488      -0.379281    236.679    -79.3997     47.5631   96.4396      
1 1 1 8  6  2  o 0 60.9125  0.847045  -39.6623     -1.17605     -20.5646     -1.7882      239.995    126.081      80.7832   -167.717     
1 1 1 8  6  3  o 0 74.4803  0.922527  3.89872      17.9881      7.20029      -3.81295     235.59     129.406      92.5135   -65.27       
1 1 1 8  6  4  o 0 50.8634  0.49384   18.917       -1.85741     -15.8576     3.90179      213.402    72.2504      90.0771   128.453      
1 1 1 8  6  5  o 0 40.1904  0.39513   5.53404      -8.53489     1.52054      3.76716      155.716    -6.6446      24.3966   -64.6838     
1 1 1 8  6  6  o 0 15.026   0.539935  14.1897      12.6851      -0.69267     -7.00904     78.1114    44.7339      74.1945   34.1723      
1 1 1 8  6  7  f 1 13.6182  0.490267  -11.6691     -9.32472     -1.52457     -6.37954     71.9008    -174.778     62.3597   -151.336     
1 1 1 8  6  8  o 0 76.509   1.7974    -32.433      -0.880334    -9.49825     0.100848     345.386    -155.604     113.995   -151.331     
1 1 1 8  6  9  o 0 28.3337  0.155392  0.262002     -0.900808    2.76353      0.856012     152.229    4.4201       96.53     1.96173      
1 1 1 8  6  10 f 1 26.3982  0.941193  -27.9084     23.9879      -1.31691     9.60967      66.8262    142.667      58.8042   -42.829      
1 1 1 8  6  11 o 0 24.5992  0.701478  -22.2635     1.84237      -5.37474     0.841214     85.7085    161.581      55.3912   -98.9986     
1 1 1 8  6  12 o 0 2.45994  0.545395  -9.49397     -8.54019     -0.42538     -4.13384     19.0646    155.223      36.197    132.056      
1 1 1 8  6  13 o 0 33.9498  0.915964  16.0705      13.1693      -1.10582     -4.52038     128.098    7.31993      31.0698   101.928      
1 1 1 8  6  14 o 0 15.3112  0.759544  42.6323      0.400715     -17.4947     -0.081139    65.7366    37.248       40.6455   -22.6545     
1 1 1 8  6  15 o 0 46.2829  0.292     -2.72599     2.9413       0.715281     2.21726      164.848    34.9052      32.2664   161.72       
1 1 1 8  6  16 o 0 15.4507  0.37836   -9.60579     11.4136      0.906127     6.48953      49.0149    85.3809      34.0177   -163.919     
1 1 1 8  6  17 o 0 4.16291  0.145993  -2.97874     -0.709349    -5.59322     -2.49157     6.51268    171.43       11.4787   -124.359     
1 1 1 8  6  18 f 1 16.172   0.989695  -15.8295     -3.04611     -3.28025     -1.1532      65.9705    -147.823     43.75     136.126      
1 1 1 8  6  19 o 0 4.75785  0.59085   0.0342881    -3.03582     1.09254      -0.0768582   13.4949    -86.8238     8.46824   2.62352      
1 1 1 8  6  20 o 0 15.6539  0.655553  5.4933       -2.15168     -2.03261     1.14646      68.5838    -61.9852     17.2806   -75.6528     
1 1 1 8  7  0  f 1 37.5033  0.243722  0.137108     0            0            0            141.303    0            36.8306   180          
1 1 1 8  7  1  o 0 25.004   0.931781  18.8701      -50.2001     13.2005      11.4314      75.3574    -94.955      24.081    117.213      
1 1 1 8  7  2  o 0 14.8507  0.150664  -10.3569     3.97752      -13.569      11.9114      34.4663    -88.2414     179.426   -96.3835     
1 1 1 8  7  3  o 0 70.2275  1.57253   5.72128      53.2752      15.9392      -3.05299     327.708    109.442      130.458   112.886      
1 1 1 8  7  4  f 1 68.9351  1.3285    19.4084      11.4068      -2.57989     -4.08495     310.588    54.876       107.813   41.1071      
1 1 1 8  7  5  o 0 35.147   0.562797  12.1611      8.43979      -1.16617     -3.30067     102.18     58.6498      63.9903   -92.8748     
1 1 1 8  7  6  o 0 31.0426  0.835451  -2.77301     -33.3069     9.01742      -1.41814     82.7345    -112.917     98.0183   8.86562      
1 1 1 8  7  7  o 0 19.8672  1.13584   -27.3315     54.2091      11.8463      15.7718      103.049    138.668      83.7906   101.516      
1 1 1 8  7  8  o 0 5.928    0.625339  10.3482      -15.4203     2.07975      5.15206      38.0303    -31.7361     50.8662   -5.58302     
1 1 1 8  7  9  f 1 26.8813  0.174971  0.222846     2.82311      12.5233      -5.61948     101.872    172.237      32.9598   -107.546     
1 1 1 8  7  10 o 0 89.9496  0.74252   4.43674      11.551       2.95237      -1.66903     366.375    5.59976      48.8802   60.5815      
1 1 1 8  7  11 o 0 35.324   1.12518   40.2599      -3.21422     -11.1426     2.14537      128.252    -24.7408     18.3158   116.51       
1 1 1 8  7  12 o 0 17.4943  0.631505  -2.17929     30.4694      16.6183      2.82187      98.9798    146.761      74.4402   121.043      
1 1 1 8  7  13 f 1 54.0792  0.673454  5.70104      -11.0112     3.12221      3.39987      207.123    -10.8038     6.53555   -106.3       
1 1 1 8  7  14 o 0 26.8855  0.209901  2.89259      1.69239      -0.966352    -1.27132     128.74     -27.907      57.3843   -27.5188     
1 1 1 8  7  15 f 1 51.4899  0.229917  5.46813      6.21776      1.75274      -4.96357     215.695    -12.4958     44.0713   -13.4399     
1 1 1 8  7  16 o 0 13.644   0.585114  -6.61641     -31.0016     11.7969      -5.09562     29.2922    -147.321     42.9506   19.0404      
1 1 1 8  7  17 o 0 8.96983  0.600521  -6.57279     2.18083      -1.43968     1.12929      45.9919    160.412      29.2638   164.858      
1 1 1 8  7  18 o 0 23.6066  1.26251   -7.12353     11.0774      0.997557     1.86881      105.852    134.887      24.0609   123.36       
1 1 1 8  7  19 o 0 20.0736  0.73615   -1.00927     3.68172      1.28845      0.236054     71.6433    149.282      14.5377   -21.5907     
1 1 1 8  8  0  o 0 16.4985  0.141223  0.0220948    0            0            0            61.4615    0            8.97491   -180         
1 1 1 8  8  1  o 0 66.8436  0.446154  -14.1445     -6.57274     -6.09988     -6.06353     260.773    -93.0206     19.8924   -114.229     
1 1 1 8  8  2  o 0 21.4658  0.734292  38.3829      11.3268      -17.3931     -11.5975     65.9481    -28.8324     51.7346   87.2082      
1 1 1 8  8  3  o 0 49.1993  0.226675  0.668178     4.63889      4.15871      -0.622774    192.055    25.368       41.3977   -39.852      
1 1 1 8  8  4  o 0 24.1027  0.532114  -16.6123     8.81092      -4.66285     7.10849      41.7891    114.796      107.184   -103.672     
1 1 1 8  8  5  o 0 54.6299  0.707345  17.8127      -3.48412     -13.4567     6.98843      230.01     58.7928      49.6503   46.0022      
1 1 1 8  8  6  o 0 46.8198  0.204666  -2.14579     -4.23691     6.21906      -5.62347     167.251    167.19       25.2892   36.2358      
1 1 1 8  8  7  o 0 32.2664  0.382443  -18.4871     0.761292     -14.3815     0.669527     90.9273    101.601      66.9094   -47.6039     
1 1 1 8  8  8  o 0 21.8568  0.212815  7.65141      2.3631       -8.42843     -5.10885     105.233    109.971      87.2547   155.806      
1 1 1 8  8  9  o 0 22.9005  0.491666  -13.27       3.20021      -4.5383      2.54833      71.8031    -163.804     87.899    99.4301      
1 1 1 8  8  10 o 0 31.74    0.725607  -9.69397     24.7131      5.90424      5.77765      116.92     87.7785      17.4637   -25.4802     
1 1 1 8  8  11 o 0 37.4878  1.7349    88.034       -4.99754     -20.9558     2.01434      153.258    -3.4173      18.504    -18.7897     
1 1 1 8  8  12 o 0 31.7757  1.17615   -15.8597     -34.9719     5.96041      -7.17362     143.124    -123.082     45.4786   -114.666     
1 1 1 8  8  13 o 0 22.2774  0.186772  7.20247      0.311863     -6.67344     -1.20421     86.2434    81.5712      31.5403   158.545      
1 1 1 8  8  14 o 0 30.252   0.177805  1.98731      -0.0286246   -2.09242     -0.525427    137.18     -78.6259     49.9907   -65.6879     
1 1 1 8  8  15 f 1 36.3874  0.795706  17.452       -1.39074     -6.51532     1.48479      146.863    36.2388      23.8116   55.1488      
1 1 1 8  8  16 o 0 8.05812  0.812862  -2.37436     14.4199      3.98534      1.24132      31.0726    105.701      5.84772   48.6925      
1 1 1 8  8  17 o 0 4.87298  1.1765    -30.1312     0.147755     -8.58584     -0.0113867   32.0392    179.112      29.6336   -177.184     
1 1 1 8  8  18 o 0 13.8926  0.906479  1.12064      2.73785      0.354276     -0.517154    55.7544    30.5675      9.03801   89.518       
1 1 1 8  8  19 o 0 20.3986  0.212939  -0.400704    -0.692282    0.288345     -0.103344    90.7218    -136.204     23.4972   -140.423     
1 1 1 8  9  0  o 0 79.3246  0.53219   -0.703665    8.61741e-17  0            0            300.352    180          5.99406   -1.15922e-12 
1 1 1 8  9  1  o 0 42.5213  0.63125   -19.3944     6.70445      -3.94208     3.26853      128.345    178.724      61.3419   3.88554      
1 1 1 8  9  2  o 0 32.1994  0.181183  -4.69334     9.63864      4.72091      5.61631      166.063    47.9662      94.235    59.3436      
1 1 1 8  9  3  o 0 13.1116  0.568839  -1.24718     -14.9486     4.34743      -0.685418    21.8579    -98.3276     46.5404   98.3868      
1 1 1 8  9  4  o 0 13.5983  0.362802  -7.77804     -18.2184     12.453       -13.4112     68.4199    -60.2331     56.9901   -101.062     
1 1 1 8  9  5  o 0 45.7001  0.570104  11.6822      1.50547      -4.63589     -0.988277    175.236    45.7072      21.8817   107.042      
1 1 1 8  9  6  o 0 22.0962  1.96769   -15.9399     -184.001     45.7257      -8.2372      85.5717    -95.7854     29.7004   -164.237     
1 1 1 8  9  7  o 0 31.1833  0.14709   -5.00887     2.76375      -6.93191     7.90659      98.2975    83.3516      71.7069   -152.207     
1 1 1 8  9  8  o 0 13.2131  0.532796  5.89411      17.15        3.87809      -2.93989     67.1746    68.4931      49.3827   97.2847      
1 1 1 8  9  9  o 0 6.1928   0.0960908 -1.28454     0.279317     -0.489882    0.233607     41.6115    159.264      79.3294   146.953      
1 1 1 8  9  10 o 0 9.93539  0.368979  -3.58245     26.2734      27.3094      7.02024      42.6895    136.882      53.0888   74.3508      
1 1 1 8  9  11 o 0 39.6885  0.979731  32.465       -3.69922     -10.3002     1.86052      160.393    -49.1489     23.8907   -2.39709     
1 1 1 8  9  12 o 0 13.6462  0.58362   -5.58531     -39.3745     28.2851      -7.61533     75.6171    -173.346     49.7083   172.838      
1 1 1 8  9  13 o 0 15.7179  0.555944  -15.1003     -2.8981      -4.26511     -1.59601     63.8649    -143.094     17.6865   179          
1 1 1 8  9  14 o 0 36.1642  0.182223  -0.157366    0.780357     0.410378     0.966909     112.98     9.00678      46.3952   172.37       
1 1 1 8  9  15 o 0 14.9733  0.504662  4.58743      0.906356     -1.49792     -0.466868    61.2838    60.7835      18.808    -15.3449     
1 1 1 8  9  16 o 0 23.978   1.23928   0.362022     -30.3346     10.3081      -0.265431    104.541    -48.8658     15.8003   -43.0043     
1 1 1 8  9  17 o 0 20.2509  0.263211  -0.0969566   0.576698     0            0            88.5098    -130.541     17.4818   -138.672     
1 1 1 8  9  18 o 0 5.75326  0.312775  0.182739     0.0945336    0            0            11.1972    15.678       11.9016   -172.511     
1 1 1 8  10 0  o 0 20.5183  0.149984  -0.117901    1.44387e-17  0            0            76.5729    0            18.1722   0            
1 1 1 8  10 1  o 0 60.8586  0.571194  -4.93314     0.753454     -15.9176     -3.74905     206.387    99.9115      59.6235   -39.3409     
1 1 1 8  10 2  o 0 27.5767  0.483307  -1.1263      13.8314      3.05409      0.418302     100.187    92.8853      5.36108   -164.562     
1 1 1 8  10 3  o 0 18.3011  0.164577  -0.981068    0.729332     -0.0960255   0.366145     79.3148    119.032      43.6865   123.506      
1 1 1 8  10 4  o 0 13.482   0.235314  7.30447      7.52432      0.330029     -5.69186     86.4322    81.9579      101.624   51.0442      
1 1 1 8  10 5  o 0 12.6907  0.252147  -25.0737     0.643406     -49.787      3.77595      41.6209    -127.838     48.3231   136.682      
1 1 1 8  10 6  o 0 7.29521  0.32316   1.75041      -18.6026     15.9867      2.85535      16.9207    53.5675      43.7721   106.371      
1 1 1 8  10 7  o 0 21.5827  1.15147   89.6201      -32.1356     -23.8394     19.2446      115.223    -48.6015     71.3742   -24.9905     
1 1 1 8  10 8  o 0 8.33521  0.110355  -3.45045     2.65982      -1.93015     6.11024      33.4917    -102.952     42.6074   -42.1132     
1 1 1 8  10 9  o 0 9.64981  0.0846751 0.0881768    0.197406     -2.3621      -7.13526     49.1407    127.97       30.4307   134.671      
1 1 1 8  10 10 o 0 44.3362  0.729521  -3.82696     -7.64777     2.46248      -2.676       187.603    -135.324     36.6685   -151.068     
1 1 1 8  10 11 o 0 42.686   0.626367  34.9146      2.45141      -22.2283     -1.62796     181.21     68.2842      44.376    33.6233      
1 1 1 8  10 12 o 0 33.2496  0.907949  6.99881      -29.3694     7.76618      4.28556      139.684    -74.11       30.6454   -79.1525     
1 1 1 8  10 13 o 0 10.2449  0.763756  28.0311      -14.6729     -5.12213     7.52966      51.4838    -14.1317     38.0214   -45.8811     
1 1 1 8  10 14 o 0 14.4436  0.652732  -8.13325     0.657198     -2.15915     0.475055     53.7475    160.169      8.50294   -61.3057     
1 1 1 8  10 15 o 0 16.906   1.39083   29.7517      13.3919      -4.30643     -5.15602     75.9894    19.7449      17.9379   36.8514      
1 1 1 8  10 16 o 0 6.28542  1.13189   -0.6947      -5.86317     1.03304      -0.329732    13.3187    -65.8442     36.803    28.1048      
1 1 1 8  10 17 o 0 19.7965  0.305898  0.127017     -1.02588     0            0            72.7579    -112.561     10.606    47.7777      
1 1 1 8  11 0  o 0 35.4824  0.226828  0.333635     0            0            0            141.651    0            33.0726   180          
1 1 1 8  11 1  o 0 34.0842  0.59674   17.0557      14.5329      -1.78877     -8.69562     110.9      -8.84394     49.6797   -164.33      
1 1 1 8  11 2  o 0 47.9579  0.503288  3.06191      7.99254      4.26902      -2.87913     195.393    10.8793      21.235    -40.3954     
1 1 1 8  11 3  o 0 13.2331  0.462968  -3.45019     -25.323      13.7896      -3.65108     53.224     -34.0958     17.3389   -1.46629     
1 1 1 8  11 4  o 0 23.2582  0.694081  -3.3672      27.9558      10.7889      2.4263       71.877     154.558      78.9446   -105.545     
1 1 1 8  11 5  o 0 18.0937  0.160884  5.90316      -2.81252     -6.37132     6.99304      24.0793    80.9071      101.438   -139.637     
1 1 1 8  11 6  o 0 24.8673  0.279625  0.633522     10.6349      24.296       -6.00963     126.383    168.478      58.5281   175.556      
1 1 1 8  11 7  o 0 39.1747  1.30212   31.4347      28.3803      -0.623643    -8.02684     171.375    63.2328      57.514    18.6579      
1 1 1 8  11 8  f 1 10.4062  0.635967  21.4511      11.048       -5.26464     -7.22701     24.254     -7.52509     23.9227   -160.181     
1 1 1 8  11 9  o 0 18.1236  0.414402  -0.740008    17.9471      16.9621      2.18785      60.6615    169.687      18.6559   -25.0725     
1 1 1 8  11 10 o 0 25.3733  0.221416  8.72158      -13.6391     8.85166      15.7335      98.2166    23.8119      32.4999   104.944      
1 1 1 8  11 11 o 0 45.2529  0.824621  -9.69479     1.17251      -3.96097     0.496618     187.508    -177.332     31.6148   -176.926     
1 1 1 8  11 12 o 0 35.6043  0.463486  4.26936      11.3581      11.5718      -7.60653     123.715    -4.01849     34.5787   120.341      
1 1 1 8  11 13 o 0 14.9861  0.241155  -2.54924     -4.61332     6.24129      -6.58401     73.048     166.353      23.5119   175.507      
1 1 1 8  11 14 f 1 30.7283  0.692364  10.3732      -1.67219     -2.67684     0.591496     136.128    -53.2565     26.162    -23.4353     
1 1 1 8  11 15 o 0 13.0871  1.02509   -2.8308      4.43426      0.551683     0.913509     35.0717    127.438      32.7998   -55.237      
1 1 1 8  11 16 o 0 15.5531  0.259255  -0.686605    -0.257916    0            0            41.8528    -61.3767     38.7231   131.124      
1 1 1 8  12 0  o 0 15.2938  0.120019  0.105424     0            0            0            61.0404    0            3.17319   180          
1 1 1 8  12 1  o 0 15.4415  0.870214  34.8075      -6.61274     -8.80613     3.33887      50.2584    -3.63613     41.3809   -110.826     
1 1 1 8  12 2  o 0 31.7744  0.759424  28.9848      -7.68395     -12.5316     7.75423      133.654    -73.8805     18.252    -48.9911     
1 1 1 8  12 3  o 0 10.2769  0.33152   0.8165       6.66049      3.07329      -0.856568    29.3846    53.9685      8.25236   -78.8411     
1 1 1 8  12 4  o 0 25.9084  1.06295   -49.5368     -7.13333     -16.0052     -5.14235     123.163    159.808      55.7847   134.717      
1 1 1 8  12 5  o 0 15.5464  0.830948  30.1228      8.36196      -6.82224     -4.00827     71.6281    13.8646      28.1025   24.9436      
1 1 1 8  12 6  o 0 18.5636  0.563917  -7.91811     11.5291      1.8748       4.53122      64.9814    164.653      26.0747   51.1617      
1 1 1 8  12 7  o 0 25.4076  0.591292  -19.6647     18.0295      -1.45476     11.7336      89.6554    82.7164      18.2006   -73.9323     
1 1 1 8  12 8  o 0 14.6042  0.108341  2.07396      -1.01431     -31.3449     16.7472      46.0055    -119.34      36.4034   124.652      
1 1 1 8  12 9  o 0 11.3361  0.482859  2.78445      22.0539      13.4085      -3.20241     18.036     139.99       51.0923   -24.7144     
1 1 1 8  12 10 o 0 55.9728  0.292117  3.61884      0.398845     -3.58404     -2.88626     229.688    88.8287      33.7619   101.08       
1 1 1 8  12 11 o 0 3.84757  0.689706  13.0409      3.05185      -4.69793     -2.42554     18.6774    29.0693      27.064    65.7615      
1 1 1 8  12 12 o 0 14.748   0.958394  17.6218      -11.6067     -1.77069     4.46843      73.5369    -28.0185     29.9095   -32.3796     
1 1 1 8  12 13 o 0 23.8793  0.42977   -5.85083     8.77936      1.72762      3.35099      91.8354    -176.28      32.197    78.0168      
1 1 1 8  12 14 o 0 17.9986  0.153528  1.02999      1.07796      -3.9627      -0.247763    50.4613    88.6356      45.3769   -107.875     
1 1 1 8  12 15 o 0 27.2948  0.390269  -2.0512      -1.40508     0.868676     -1.23143     90.1433    -168.816     39.3072   28.0834      
1 1 1 8  13 0  o 0 12.3531  0.128185  0.0171788    0            0            0            48.7809    0            3.13259   180          
1 1 1 8  13 1  o 0 22.7546  0.290356  -1.18157     -4.51659     7.01399      -5.44224     96.1926    -29.5412     23.5697   -82.9347     
1 1 1 8  13 2  o 0 14.6687  0.465639  -12.7054     -5.81008     -2.94096     -3.57811     45.0923    -156.984     17.0908   35.2042      
1 1 1 8  13 3  o 0 6.7779   0.961994  -9.21903     -67.271      30.6131      -8.71403     17.2856    22.5478      47.2089   81.0687      
1 1 1 8  13 4  f 1 48.7632  0.303915  5.32435      0.571351     -1.90737     -0.135425    198.031    -70.3782     21.9197   -22.6796     
1 1 1 8  13 5  f 1 27.502   0.769271  8.25255      -20.8696     3.64199      3.20957      71.8471    -76.5419     70.0601   91.0109      
1 1 1 8  13 6  o 0 15.1102  0.234275  2.46183      4.83233      1.77404      -2.12861     70.4926    115.367      31.649    123.427      
1 1 1 8  13 7  o 0 33.7535  0.205337  -4.55503     -14.5332     11.8397      -6.67374     135.543    -178.67      19.4521   -123.413     
1 1 1 8  13 8  o 0 13.6203  0.129046  1.15336      -0.0396291   -12.7974     -5.12422     41.7402    -51.7452     52.1542   45.8907      
1 1 1 8  13 9  o 0 13.8526  1.62481   1.08403      63.0737      17.5829      -0.951087    48.8502    87.4309      9.10182   -166.759     
1 1 1 8  13 10 o 0 6.63089  0.552394  -11.1483     0.818452     -4.24676     0.742272     25.4175    -163.985     16.194    122.203      
1 1 1 8  13 11 o 0 30.6432  0.622207  -1.33061     2.23532      0.0764363    0.124011     143.645    69.0619      36.802    83.8326      
1 1 1 8  13 12 f 1 8.67556  0.293452  3.23982      2.8017       -0.251912    -1.32448     19.4514    13.6135      35.9296   143.831      
1 1 1 8  13 13 o 0 25.1707  1.55533   0.0784467    -20.6558     4.16222      -0.608577    104.853    -92.6289     10.3461   -42.2389     
1 1 1 8  13 14 o 0 10.0646  0.205352  1.3176       0.70822      -1.9165      -0.78515     54.1499    89.9387      31.0115   92.1104      
1 1 1 8  14 0  o 0 16.9676  0.146077  -0.050732    6.21288e-18  0            0            63.7664    0            45.4443   -1.96083e-14 
1 1 1 8  14 1  o 0 43.411   0.678808  7.20271      7.05142      0.0718502    -1.61654     189.261    51.0603      35.7573   47.2362      
1 1 1 8  14 2  o 0 21.7933  1.33152   -58.7298     2.47483      -17.0213     1.76226      97.7274    173.613      29.1785   177.547      
1 1 1 8  14 3  o 0 16.3158  0.311265  1.51047      -8.63887     6.12832      1.89658      77.8067    -11.0831     31.368    7.77723      
1 1 1 8  14 4  o 0 37.0302  0.515651  -20.4419     1.85052      -12.5512     3.39352      130.737    -121.107     28.4723   45.1266      
1 1 1 8  14 5  o 0 6.64412  0.45826   11.4363      -6.04834     -2.56724     3.90384      20.8889    -32.4453     38.4481   -106.896     
1 1 1 8  14 6  o 0 39.0753  0.259147  -0.77599     -0.215879    -0.136521    -0.266563    155.47     -144.577     10.0104   -149.12      
1 1 1 8  14 7  f 1 15.4785  0.477219  -0.861425    -5.31191     2.16836      -0.51516     71.571     -154.592     26.6827   -103.156     
1 1 1 8  14 8  o 0 12.8932  1.03032   35.4206      -3.76124     -14.0543     3.46138      54.6741    -56.3935     1.86294   -68.6958     
1 1 1 8  14 9  o 0 38.7913  1.31499   -9.73402     22.2089      3.81566      3.37597      154.67     147.952      29.2072   29.4596      
1 1 1 8  14 10 o 0 26.9669  0.199814  2.08303      0.47284      -5.73662     1.74652      116.127    75.9399      9.69198   96.359       
1 1 1 8  14 11 o 0 12.6815  0.331939  0.3433       -0.627191    0.0617176    0.249613     44.7929    -124.765     11.7448   30.214       
1 1 1 8  14 12 o 0 14.5449  1.12264   5.33321      0.715491     -0.878556    -0.389608    67.4079    35.7577      23.6989   7.24255      
1 1 1 8  15 0  o 0 2.82843  0.228301  -0.0451008   5.52326e-18  0            0            0.26777    0            4.19696   180          
1 1 1 8  15 1  o 0 20.849   0.3875    -1.57545     2.89731      0.955655     1.11802      90.9939    53.179       8.50468   121.334      
1 1 1 8  15 2  o 0 29.2795  0.813258  -4.56992     2.44102      -0.484855    0.951924     167.713    -168.064     84.4895   -172.664     
1 1 1 8  15 3  o 0 2.96495  0.232583  0.0316342    0.565258     3.98495      -1.81661     11.5765    -119.324     25.1982   -122.409     
1 1 1 8  15 4  o 0 37.5468  0.760641  -4.084       -6.67778     0.55647      -2.48572     165.695    -50.5527     33.2159   -121.832     
1 1 1 8  15 5  o 0 38.5332  0.254246  0.643067     2.48817      0.979491     -1.80365     165.88     176.428      29.3172   94.987       
1 1 1 8  15 6  o 0 6.48733  0.511131  1.67415      -8.63086     3.4337       1.28717      26.2463    -62.8276     12.0942   -76.8499     
1 1 1 8  15 7  o 0 12.8242  0.933558  4.58694      -16.0767     3.37889      1.92705      63.183     -64.4216     22.71     -73.3341     
1 1 1 8  15 8  o 0 4.31894  0.232959  1.22323      0.114691     -1.42134     0.137003     11.7279    49.0709      8.7945    -46.2683     
1 1 1 8  15 9  o 0 6.14041  0.845105  -0.915094    -8.12132     3.17882      -1.00577     28.6331    -65.8739     15.9589   -98.6544     
1 1 1 8  15 10 o 0 4.66623  1.59157   7.85118      9.22786      0.281689     -2.1171      15.7959    -73.913      62.5449   -98.5687     
1 1 1 8  15 11 f 1 27.9257  1.41716   5.23554      2.14779      -0.342335    -0.625496    107.502    -16.5133     16.3505   118.549      
1 1 1 8  16 0  f 1 37.8774  0.487386  -0.184274    2.2567e-17   0            0            166.365    180          19.8455   -180         
1 1 1 8  16 1  o 0 21.9066  0.253032  4.25012      1.55089      -4.90335     -2.33141     89.6327    91.0941      10.7763   -74.1942     
1 1 1 8  16 2  o 0 3.38706  0.289052  -2.35878     -0.617442    -1.07207     -0.671115    9.07685    -173.336     4.72812   126.358      
1 1 1 8  16 3  o 0 43.7475  0.374284  -0.91133     0.340357     0.207286     0.2436       199.784    164.567      22.8669   168.504      
1 1 1 8  16 4  o 0 6.90192  0.917749  -3.53838     3.24544      -0.165647    1.09527      28.8685    138.814      8.40042   97.3304      
1 1 1 8  16 5  o 0 15.2714  0.53155   -4.90307     -0.0568173   -3.03925     1.00512      81.8209    -119.946     36.5354   -127.191     
1 1 1 8  16 6  o 0 14.2144  0.165429  0.450176     0.00669301   0.81474      0.42686      41.4411    169.689      37.4353   -39.2453     
1 1 1 8  16 7  o 0 19.2025  0.671105  -3.83941     -2.45946     -0.901454    -1.07116     77.6086    -100.222     8.29662   144.886      
1 1 1 8  16 8  o 0 5.22687  0.673971  3.86377      0.0496982    -1.07372     -0.102579    19.5965    -4.44759     8.33007   52.9236      
1 1 1 8  17 1  f 1 16.5318  0.361016  -0.149429    0.369802     0            0            22.0789    122.469      97.3795   -56.3246     
1 1 1 8  17 2  o 0 24.976   0.45025   0.579749     -0.182517    0            0            118.36     75.5142      23.7369   68.3941      
1 1 1 8  17 3  o 0 4.72229  0.279435  0.0246428    -0.0473454   0            0            0.205624   -70.1288     28.4564   120.477      
1 1 1 8  17 4  o 0 22.9456  0.318063  -0.77457     0.557504     0            0            101.883    116.263      10.9355   129.576      
1 1 1 9  0  1  o 0 11.0815  0.146935  -7.01966e-18 -0.0382133   0            0            11.6779    -90          7.87626   90           
1 1 1 9  0  2  o 0 27.5445  0.237555  0.119223     0            0            0            102.876    0            13.3895   180          
1 1 1 9  0  3  o 0 10.4115  0.142118  -4.24949e-18 -0.0231332   0            0            31.6553    -90          59.7951   90           
1 1 1 9  0  4  o 0 15.9562  0.167447  0.0662428    0            0            0            35.9741    180          5.13843   -1.29947e-13 
1 1 1 9  0  5  o 0 73.584   0.518191  1.59255e-17  0.0520165    0            0            278.596    -90          48.2796   -90          
1 1 1 9  0  6  o 0 39.6144  0.316785  -0.0334294   4.09392e-18  0            0            151.837    0            24.8661   2.53401e-14  
1 1 1 9  0  7  o 0 13.1985  0.134992  1.11558e-18  0.00364377   0            0            36.5485    -90          24.7103   90           
1 1 1 9  0  8  o 0 29.2438  0.212175  -0.122309    1.49786e-17  0            0            111.666    0            1.16884   2.7372e-13   
1 1 1 9  0  9  o 0 69.2892  0.443826  1.10225e-16  0.360022     0            0            264.116    -90          27.7063   -90          
1 1 1 9  0  10 o 0 53.8396  0.336856  -0.0576842   7.06428e-18  0            0            204.241    180          39.6315   -180         
1 1 1 9  0  11 o 0 4.90917  0.195739  1.47046e-18  0.00480289   0            0            8.93883    90           41.2071   -90          
1 1 1 9  0  12 o 0 48.0687  0.344935  0.0805035    0            0            0            189.186    0            47.3937   2.50446e-14  
1 1 1 9  0  13 o 0 62.9532  0.439316  -8.1898e-17  -0.445832    0            0            245.723    90           2.40859   -90          
1 1 1 9  0  14 o 0 15.6748  0.173509  0.101602     0            0            0            60.4022    0            13.6703   0            
1 1 1 9  0  15 o 0 2.46982  0.320129  -1.50893e-18 -0.00821422  0            0            1.40952    -90          12.2328   90           
1 1 1 9  0  16 f 1 20.7147  0.1676    0.0944671    0            0            0            78.4556    0            5.34854   180          
1 1 1 9  0  17 o 0 28.1301  0.197681  -1.8914e-17  -0.102963    0            0            105.318    -90          10.1179   -90          
1 1 1 9  0  18 o 0 31.8481  0.216743  -0.318242    3.89734e-17  0            0            130.314    0            11.6347   4.70949e-14  
1 1 1 9  0  19 o 0 4.63681  0.216136  1.10865e-17  0.0362114    0            0            3.21439    -90          4.64603   90           
1 1 1 9  0  20 o 0 17.0792  0.287861  -0.440097    5.38963e-17  0            0            68.0765    180          1.66157   -180         
1 1 1 9  1  0  o 0 40.0762  0.318104  -1.17212e-17 -0.0638073   0            0            147.397    90           31.2489   90           
1 1 1 9  1  1  f 1 24.9916  0.363397  -16.0994     1.61149      -14.5304     3.23634      67.0667    137.465      65.9429   144.651      
1 1 1 9  1  2  o 0 48.5825  0.422128  2.24359      -9.42561     4.96544      2.68492      194.465    -139.051     33.1382   -150.809     
1 1 1 9  1  3  f 1 28.1299  1.0935    87.0095      -4.17077     -39.3597     3.54538      92.5546    39.7154      55.4568   -69.1328     
1 1 1 9  1  4  o 0 17.8219  1.2262    -17.2226     -57.6227     10.2197      -6.64682     69.8943    -140.331     93.6799   155.262      
1 1 1 9  1  5  o 0 12.5186  0.583018  -18.5037     -9.04294     -3.40696     -4.34157     53.686     -106.513     112.171   -59.8858     
1 1 1 9  1  6  o 0 26.0016  0.667937  10.92        -13.613      1.12698      4.80221      74.5139    -41.3565     37.3568   146.855      
1 1 1 9  1  7  o 0 68.5869  0.318351  -2.9704      0.982168     -2.13377     1.18046      298.954    -122.936     80.2889   -124.871     
1 1 1 9  1  8  o 0 51.3482  0.866594  2.41784      -12.9545     4.56321      1.39763      201.932    -131.71      22.9429   -87.2701     
1 1 1 9  1  9  f 1 15.2495  0.97946   -30.5916     -2.86053     -5.9218      -1.16035     75.1462    -178.38      42.2335   163.681      
1 1 1 9  1  10 o 0 34.63    0.248651  2.70669      3.48773      0.400337     -1.45973     102.849    76.7925      50.6427   -108.533     
1 1 1 9  1  11 o 0 23.3856  0.267172  -0.0785713   1.29878      0.26669      0.0347748    85.4853    125.132      8.25368   78.0878      
1 1 1 9  1  12 o 0 14.0045  0.104289  1.33804      -0.554018    -1.26348     1.1103       9.55143    -136.659     124.013   -127.763     
1 1 1 9  1  13 o 0 22.9036  0.539273  -18.2725     7.35796      -4.58488     4.63502      106.66     -169.836     43.6488   -173.626     
1 1 1 9  1  14 o 0 15.3011  0.102836  -0.243562    -1.31564     7.82993      -0.401503    80.0703    -179.853     43.8755   176.549      
1 1 1 9  1  15 o 0 10.3998  0.509136  -14.8566     -1.15254     -4.68221     -0.672486    24.2602    -172.131     22.0701   1.03327      
1 1 1 9  1  16 o 0 28.7051  0.431657  -3.98927     -7.46525     3.89496      -4.56332     142.357    179.371      72.5685   168.558      
1 1 1 9  1  17 o 0 23.855   0.162958  -0.5026      2.7474       1.48195      0.849476     81.0415    44.0943      14.0476   -118.712     
1 1 1 9  1  18 o 0 5.55471  0.439509  3.07379      -4.19767     0.571491     1.58805      27.4433    -51.5499     21.4404   -46.4762     
1 1 1 9  1  19 o 0 17.3032  0.370282  -8.65317     1.60899      -6.90002     1.88267      67.5266    97.1197      19.541    3.66274      
1 1 1 9  1  20 f 1 9.67657  1.38099   0.893231     8.96876      1.56846      -0.207035    44.6712    81.3882      17.2385   82.5573      
1 1 1 9  2  0  o 0 43.0302  0.327499  3.54561e-17  0.115809     0            0            157.879    -90          15.0713   -90          
1 1 1 9  2  1  o 0 18.8854  0.298809  10.8724      12.0814      1.7116       -19.0573     30.1973    82.3731      103.326   -30.4895     
1 1 1 9  2  2  o 0 32.6547  1.61756   -5.9142      -97.9443     25.0014      -2.90124     130.819    -94.8546     28.6224   -105.22      
1 1 1 9  2  3  o 0 83.6668  0.381535  -6.22233     0.376038     -3.68936     -0.0318254   334.267    -119.137     49.5504   -111.999     
1 1 1 9  2  4  o 0 25.9559  0.459008  4.7846       -20.9709     15.7121      7.89254      42.6121    -144.27      108.316   27.8323      
1 1 1 9  2  5  o 0 109.019  0.817127  0.649537     -6.29935     1.26982      0.060439     417.994    -23.1331     36.7405   -77.9471     
1 1 1 9  2  6  o 0 8.57893  0.202959  4.09393      2.9894       -0.728704    -2.29773     27.1565    48.5655      29.4777   96.6423      
1 1 1 9  2  7  f 1 27.9801  0.759522  26.9894      23.0779      -1.45519     -9.59183     120.59     52.4826      70.5427   0.750421     
1 1 1 9  2  8  o 0 37.8196  0.797439  8.09625      17.5939      2.9135       -3.19308     99.0095    67.1981      85.0864   -107.552     
1 1 1 9  2  9  o 0 18.4906  0.237296  -3.95569     0.873167     -5.62948     3.148        99.004     -93.5034     114.266   -54.5037     
1 1 1 9  2  10 o 0 17.1488  0.112415  -2.16139     1.38437      -0.92682     1.75842      45.1159    76.9857      51.7163   -35.556      
1 1 1 9  2  11 o 0 36.1866  0.637802  1.00772      -14.6046     3.32295      0.57486      129.779    -109.053     18.9904   -0.377374    
1 1 1 9  2  12 o 0 24.1172  0.473582  -14.5036     -6.38683     -3.61866     -4.22109     73.4837    168.779      56.7563   -66.9675     
1 1 1 9  2  13 o 0 37.6637  0.878315  -19.5816     -10.559      -2.68148     -4.46819     133.955    -134.228     30.9796   98.8898      
1 1 1 9  2  14 o 0 15.1598  0.126422  -0.386026    -2.95486     3.63407      -0.635073    34.441     -33.2018     57.494    -162.39      
1 1 1 9  2  15 o 0 37.0699  0.348024  8.11355      -4.68198     -1.81087     3.65418      135.382    30.7362      18.7751   -87.6776     
1 1 1 9  2  16 o 0 22.7906  0.344015  -4.79683     3.70963      -0.528764    2.50838      94.3479    94.4545      21.7984   87.8086      
1 1 1 9  2  17 o 0 13.8223  0.840588  -6.44905     30.9775      7.05647      3.18393      43.3871    98.1948      12.4665   -88.0357     
1 1 1 9  2  18 o 0 25.1883  0.724302  8.37742      7.86478      0.0921392    -3.67306     126.244    -5.59641     52.9117   10.3298      
1 1 1 9  2  19 o 0 15.7549  0.65468   7.97143      2.93262      -1.8278      -1.72188     62.6564    1.21713      3.24821   -34.4769     
1 1 1 9  2  20 o 0 25.139   0.513136  0.907402     -2.42781     1.82394      -0.219302    116.541    -49.1254     38.5403   -32.1687     
1 1 1 9  3  0  o 0 16.4317  0.150756  2.15232e-17  0.0703001    0            0            7.90654    -90          2.48071   90           
1 1 1 9  3  1  f 1 88.688   0.953639  -8.52261     6.24584      -1.16849     2.91409      326.267    167.615      3.9578    160.07       
1 1 1 9  3  2  o 0 68.1064  1.21988   -14.8521     23.7277      2.75204      6.06697      265.057    132.809      33.8409   114.451      
1 1 1 9  3  3  o 0 29.9498  1.16072   -64.1445     5.00812      -19.3387     2.90999      114.395    -172.854     24.4953   -176.058     
1 1 1 9  3  4  o 0 83.2374  0.446815  -3.47657     -3.57696     -0.407609    -2.71047     317.196    -67.8269     23.9073   -110.524     
1 1 1 9  3  5  o 0 24.6999  0.155066  1.25439      3.8114       6.89927      -6.02862     110.697    141.068      62.6356   93.9539      
1 1 1 9  3  6  o 0 20.0926  0.634146  34.6398      -16.5832     -11.9686     14.6856      71.1146    6.61818      46.9136   5.76166      
1 1 1 9  3  7  f 1 23.8295  0.145539  -1.03456     1.04514      0.861718     4.5851       92.2646    38.9981      26.2821   -28.742      
1 1 1 9  3  8  o 0 113.049  0.496266  1.62331      -5.87658     1.03952      1.12309      440.363    -68.1614     27.5363   -75.4965     
1 1 1 9  3  9  f 1 10.888   0.355285  4.68358      5.2683       0.271309     -2.00181     27.0636    68.1878      59.657    149.328      
1 1 1 9  3  10 o 0 13.6214  0.73046   20.6398      5.95427      -5.28658     -3.27072     63.3697    14.4869      62.4922   60.9321      
1 1 1 9  3  11 f 1 46.826   0.486693  -1.37312     8.2168       2.4904       0.935097     205.44     93.551       67.8814   91.4549      
1 1 1 9  3  12 o 0 10.0903  0.773504  -34.8526     12.2655      -8.38398     6.64784      20.2579    93.5654      78.4063   27.5054      
1 1 1 9  3  13 o 0 15.1744  0.659146  9.59659      -23.428      4.9789       4.76661      39.5217    -62.1378     32.7211   115.217      
1 1 1 9  3  14 o 0 36.0161  0.192099  -0.0879476   -2.26794     1.86371      -0.662856    138.42     -178.882     7.51751   -116.861     
1 1 1 9  3  15 f 1 28.0282  0.149319  -0.170788    -0.00381434  -0.0393486   -1.14184     82.4047    157.59       47.9161   1.08368      
1 1 1 9  3  16 o 0 37.6109  1.0978    30.671       10.7478      -5.34383     -4.59744     158.8      14.3385      38.1449   14.1166      
1 1 1 9  3  17 o 0 6.10425  0.697578  -2.68712     30.8987      11.2762      1.87604      16.5532    99.4211      4.03726   -164.418     
1 1 1 9  3  18 o 0 10.503   0.758506  -13.9058     4.02882      -3.34154     2.24962      53.8865    -179.085     32.3661   157.988      
1 1 1 9  3  19 f 1 15.7709  0.233345  -3.61012     1.47054      -1.91766     2.38233      64.1095    -137.684     9.93414   -76.5325     
1 1 1 9  3  20 o 0 21.8617  1.53432   -2.33749     -5.44684     0.413733     -0.326068    81.291     -146.528     17.4157   -32.2604     
1 1 1 9  4  0  f 1 39.6144  0.295657  -3.41649e-17 -0.185985    0            0            145.231    90           46.86     -90          
1 1 1 9  4  1  o 0 57.5235  1.67341   -14.3024     -45.1078     11.0891      -8.12654     212.97     -134.419     11.4291   -89.3072     
1 1 1 9  4  2  o 0 32.1027  0.544982  7.11485      19.7875      7.31227      -5.87264     148.486    117.67       83.8828   82.227       
1 1 1 9  4  3  o 0 36.504   0.379102  11.2526      -0.637961    -6.05782     0.522027     170.463    56.9766      85.4096   78.5622      
1 1 1 9  4  4  o 0 71.0536  0.535566  -9.30887     7.11748      -1.47195     4.34217      282.975    -171.23      37.0851   -162.182     
1 1 1 9  4  5  o 0 32.3119  1.38462   -3.21155     -85.1935     21.9532      -1.53085     117.221    -97.0334     15.2745   -4.52592     
1 1 1 9  4  6  o 0 35.3846  0.596787  17.7778      2.63416      -8.09976     -2.37332     142.858    -34.8768     113.602   32.5556      
1 1 1 9  4  7  o 0 33.6501  1.36042   27.6762      38.6141      3.5502       -10.9852     103.611    49.2374      44.5402   -152.622     
1 1 1 9  4  8  o 0 31.4888  0.607153  5.49959      1.52634      -1.05936     -0.54015     104.233    28.748       22.7497   -141.867     
1 1 1 9  4  9  o 0 55.0611  0.441193  -3.8496      5.43377      0.299696     1.06188      281.969    99.6082      156.727   102.38       
1 1 1 9  4  10 o 0 38.9025  0.888361  24.2653      4.61088      -5.08659     -2.15754     165.386    -0.722859    46.2715   9.0165       
1 1 1 9  4  11 o 0 62.0601  1.04946   -2.52828     -18.1892     4.80889      -1.77749     258.005    -114.023     35.0338   -108.666     
1 1 1 9  4  12 o 0 13.0799  0.62168   -34.9594     -2.28023     -15.0167     -1.78679     73.9291    164.049      80.62     178.01       
1 1 1 9  4  13 o 0 42.6008  0.22104   -0.532601    -2.12431     1.25507      -1.36169     175.95     -171.691     27.3411   174.081      
1 1 1 9  4  14 o 0 45.2655  0.259116  -0.238474    -0.0621987   0.0367708    -0.0512412   171.577    -115.842     0.949802  154.578      
1 1 1 9  4  15 o 0 37.812   0.975639  -6.11305     17.743       2.78222      1.99477      149.036    130.416      21.5192   85.3873      
1 1 1 9  4  16 o 0 22.0281  0.824915  -24.2874     -0.303495    -5.95111     -0.24453     85.2947    -161.218     13.0504   153.244      
1 1 1 9  4  17 o 0 4.52507  1.01627   -0.537215    41.0015      12.0844      0.268577     33.1539    92.3509      37.5301   93.0619      
1 1 1 9  4  18 o 0 14.9822  0.528833  8.63674      1.86997      -3.68572     -1.39372     67.6196    64.1884      18.1991   48.3756      
1 1 1 9  4  19 o 0 26.7979  0.188946  -0.447575    -0.0511602   0.174543     -0.240512    128.817    117.08       46.8996   121.582      
1 1 1 9  4  20 o 0 36.179   0.506186  -0.483188    -1.39779     0.30814      0.0530511    170.763    -174.102     58.8694   -170.437     
1 1 1 9  5  0  o 0 95.3226  0.636714  -9.4861e-17  -0.5164      0            0            353.78     90           1.14424   -90          
1 1 1 9  5  1  o 0 48.9476  0.237837  1.29149      -7.07142     8.61611      3.9323       206.726    -154.535     65.1887   -120.592     
1 1 1 9  5  2  o 0 68.9533  0.741418  -10.3699     6.70876      -1.84114     4.93526      271.713    -156.863     38.2699   173.235      
1 1 1 9  5  3  o 0 18.6145  0.393692  -7.46574     -2.73837     -1.53691     -1.2863      86.5594    -150.927     82.1167   165.522      
1 1 1 9  5  4  o 0 89.9294  0.954145  10.8787      0.4718       -3.08902     -0.0119583   366.457    15.9004      62.8072   21.0009      
1 1 1 9  5  5  o 0 91.7041  0.408234  1.25349      6.884        6.07085      0.0935034    360.256    167.021      39.9466   136.763      
1 1 1 9  5  6  o 0 24.8215  0.81811   40.9332      -9.18632     -18.0838     8.83403      53.8612    48.7496      78.4812   -141.319     
1 1 1 9  5  7  o 0 40.2912  0.863338  -1.30153     -17.132      4.88527      -0.893227    125.078    -116.415     48.1039   62.4538      
1 1 1 9  5  8  o 0 43.511   0.351609  0.518172     -0.055257    -0.746687    0.766597     170.732    -77.3362     25.7394   -113.27      
1 1 1 9  5  9  o 0 47.2206  0.326634  -1.56851     1.28916      0.859555     4.37892      179.157    -157.838     50.2546   -81.8688     
1 1 1 9  5  10 o 0 46.8192  0.656447  -10.9889     0.614723     -5.77809     1.21456      103.264    -174.3       139.534   -6.91927     
1 1 1 9  5  11 o 0 34.5348  1.08845   8.27481      -44.7081     10.2173      4.09528      161.75     -76.2755     62.3895   -83.8662     
1 1 1 9  5  12 o 0 10.1338  0.649134  32.2491      -7.19082     -10.7405     4.93662      16.8495    -159.087     94.3029   165.087      
1 1 1 9  5  13 o 0 20.7809  0.679097  -11.4012     -16.3679     2.21715      -5.49158     77.6831    -114.214     2.73817   -146.281     
1 1 1 9  5  14 o 0 23.1581  0.337693  -1.74156     1.80003      -0.0256875   0.493371     70.5005    165.007      31.5245   -2.13286     
1 1 1 9  5  15 o 0 28.898   0.8036    -8.28872     12.5331      1.18972      3.10225      67.1909    120.083      80.3946   -58.9119     
1 1 1 9  5  16 o 0 14.2243  0.891553  43.4959      -4.48218     -13.6639     3.01161      34.9887    -1.07546     68.6386   -99.233      
1 1 1 9  5  17 o 0 14.3327  0.369252  0.326076     -5.86761     6.53118      -0.237597    59.2306    -11.3868     10.9677   57.3567      
1 1 1 9  5  18 o 0 30.6836  0.926676  -21.0405     -4.17844     -3.38102     -1.65927     128.734    169.597      22.4144   -137.67      
1 1 1 9  5  19 f 1 28.7977  0.229386  0.169669     0.317416     0.12724      -0.04771     115.146    86.4572      3.75771   80.794       
1 1 1 9  5  20 o 0 12.9791  0.311459  -0.339112    0.00319725   -0.0966808   0.0618539    45.4517    -65.5569     7.69807   154.752      
1 1 1 9  6  0  o 0 79.6241  0.468202  1.14143e-16  0.37282      0            0            296.121    90           54.2582   -90          
1 1 1 9  6  1  o 0 6.89925  0.313125  -2.21824     28.8037      41.1045      6.20216      35.8042    -96.4786     83.2872   -102.912     
1 1 1 9  6  2  f 1 62.363   0.51982   -7.5024      1.3527       -1.59609     0.534503     205.85     161.973      48.325    -19.1818     
1 1 1 9  6  3  o 0 17.4231  0.103746  0.220194     0.261601     0.0162057    -0.100898    44.138     14.6483      20.9143   32.0984      
1 1 1 9  6  4  o 0 12.8814  1.09491   -53.3856     -17.2949     -12.3888     -8.88081     25.8951    159.433      75.8504   69.4233      
1 1 1 9  6  5  o 0 29.4367  1.57397   -10.72       -75.2487     17.172       -5.16199     108.303    -95.3666     5.29931   -178.687     
1 1 1 9  6  6  o 0 40.3793  1.15448   -35.1944     1.4681       -11.467      1.20243      153.769    -143.688     11.0484   172.681      
1 1 1 9  6  7  o 0 18.7947  0.973933  -5.21852     -32.5466     8.64522      -2.93493     67.9788    -88.1105     29.647    -169.058     
1 1 1 9  6  8  o 0 46.6533  0.283883  1.37508      -10.6235     3.99536      1.3187       173.515    -147.623     74.7828   -64.9707     
1 1 1 9  6  9  o 0 17.1219  0.64459   16.4459      10.106       -2.8702      -5.38013     49.5294    54.4132      20.6621   -110.129     
1 1 1 9  6  10 o 0 8.88002  1.13495   70.3252      41.9568      -11.5928     -21.294      19.9715    76.9679      52.0755   160.329      
1 1 1 9  6  11 o 0 30.0019  0.146992  -0.981234    -2.59595     7.82144      -4.10102     151.08     -19.2445     72.7442   -24.4376     
1 1 1 9  6  12 o 0 9.53146  0.849574  -37.0851     11.7603      -10.048      6.96582      19.4501    160.244      40.2871   39.8016      
1 1 1 9  6  13 o 0 14.0623  0.416032  9.67754      -6.2426      -2.04634     4.14841      77.9789    -0.604963    68.9679   -7.3665      
1 1 1 9  6  14 o 0 27.0084  0.39503   -1.64775     -14.2406     7.35091      -2.14035     88.3561    -158.65      25.8754   10.9935      
1 1 1 9  6  15 o 0 34.6101  0.164504  1.76001      2.87144      2.80201      -3.51089     145.444    150.311      36.0687   130.458      
1 1 1 9  6  16 o 0 16.9529  0.603654  26.5958      9.58852      -6.9659      -5.98476     77.9856    -16.209      34.6583   -0.678834    
1 1 1 9  6  17 o 0 6.07035  0.414908  -0.694574    9.1562       5.16677      0.957419     5.6477     116.311      17.0762   -72.545      
1 1 1 9  6  18 o 0 14.8827  0.301441  -2.31974     1.02018      -1.46782     2.57354      55.8995    70.9811      19.5543   170.958      
1 1 1 9  6  19 o 0 7.08374  0.205716  -0.787526    0.756213     -0.11962     0.472225     28.6825    95.8825      20.1636   109.396      
1 1 1 9  7  0  o 0 77.011   0.490945  1.64865e-16  0.53849      0            0            287.091    90           60.3752   90           
1 1 1 9  7  1  o 0 31.0752  1.31735   15.9633      50.065       12.4822      -8.62127     124.006    48.3259      21.5112   51.0437      
1 1 1 9  7  2  o 0 17.7514  0.897896  -29.559      -15.0824     -4.98954     -6.97549     46.5004    -150.546     53.3581   -32.2246     
1 1 1 9  7  3  o 0 52.9381  0.645219  11.1407      -5.52841     -2.77988     3.25362      205.216    14.6672      18.1831   13.7049      
1 1 1 9  7  4  o 0 23.2243  1.06558   -32.8597     35.3197      1.1019       13.1428      113.581    121.062      97.4224   164.676      
1 1 1 9  7  5  f 1 17.2467  0.903024  14.0669      -51.048      18.6898      11.3281      57.0511    -14.8876     23.7128   102.814      
1 1 1 9  7  6  o 0 40.9905  0.784056  32.8742      2.15707      -8.88921     -1.37536     181.294    35.7675      72.6692   4.58317      
1 1 1 9  7  7  o 0 47.8289  0.294446  -0.166779    0.319141     -0.0379007   -6.49398     183.18     135.557      17.7751   89.2408      
1 1 1 9  7  8  o 0 31.3196  0.305136  -0.0844672   -2.13548     7.00303      -3.65505     123.563    167.97       26.839    118.517      
1 1 1 9  7  9  o 0 40.296   1.3468    -59.454      28.6845      -9.96813     11.9551      186.797    136.697      89.5495   177.058      
1 1 1 9  7  10 o 0 28.7118  0.299031  4.25775      -3.79134     -0.298511    5.06094      109.536    30.9084      20.5303   117.784      
1 1 1 9  7  11 o 0 32.8129  1.31216   9.33055      -40.3734     8.25353      3.76328      145.086    -74.0951     40.7571   -72.8206     
1 1 1 9  7  12 o 0 10.825   0.71018   13.4975      9.04786      -1.19386     -2.85072     34.1446    14.8496      49.0578   -68.228      
1 1 1 9  7  13 o 0 14.4042  1.00809   47.1239      15.4511      -11.8581     -8.91001     71.1475    12.4776      44.4013   10.3933      
1 1 1 9  7  14 o 0 12.4463  0.2165    -1.64111     7.90078      9.90556      3.68541      46.9612    161.115      32.8183   83.5152      
1 1 1 9  7  15 o 0 20.6151  1.1648    50.099       -27.5423     -6.39944     9.8245       97.2968    -25.1287     46.6282   -42.5365     
1 1 1 9  7  16 o 0 11.7482  0.743484  13.2673      -6.07223     -2.26705     2.45921      40.0334    -32.9537     32.6046   68.233       
1 1 1 9  7  17 o 0 35.111   0.956469  1.05517      6.36685      1.77976      -0.976869    154.002    122.66       27.7106   118.779      
1 1 1 9  7  18 o 0 14.8397  0.358644  -0.706454    -1.85213     0.28359      -1.56814     73.8864    -59.034      33.7317   -55.4676     
1 1 1 9  7  19 o 0 26.1875  1.16915   3.92109      1.87972      -0.807823    -0.514411    94.0887    66.3439      16.3921   -93.5312     
1 1 1 9  8  0  o 0 4.75395  0.17243   -2.82939e-18 -0.0154025   0            0            9.55381    90           51.055    -90          
1 1 1 9  8  1  o 0 72.09    0.773897  -6.03928     10.6499      3.03597      7.3752       313.263    68.2244      97.808    47.7598      
1 1 1 9  8  2  o 0 27.5464  0.927761  13.7179      -31.9521     7.24114      7.83238      97.4235    -96.3636     6.02078   82.4021      
1 1 1 9  8  3  o 0 59.3688  1.08148   -23.8054     -0.214781    -7.33112     -0.449192    283.955    162.001      129.61    158.109      
1 1 1 9  8  4  o 0 32.1779  0.399442  -10.2651     -13.4321     4.82304      -15.1174     132.867    157.395      29.993    131.554      
1 1 1 9  8  5  o 0 18.3955  0.784661  -15.1171     -25.1474     3.45596      -6.4024      84.4513    -119.436     42.578    -137.557     
1 1 1 9  8  6  o 0 11.0996  1.09494   -64.1001     14.7086      -12.9772     6.20536      39.1204    -170.142     37.0873   -90.8247     
1 1 1 9  8  7  o 0 31.9837  0.954665  -22.8831     13.0276      -3.60176     6.29809      121.124    147.116      3.13055   -122.666     
1 1 1 9  8  8  o 0 76.8515  0.332881  1.56216      0.469394     8.85956      -1.64702     338.058    3.58511      91.0049   -23.7765     
1 1 1 9  8  9  o 0 38.6895  0.821094  -33.4966     -2.3508      -17.1612     -1.60266     141.961    -116.495     14.5703   56.7132      
1 1 1 9  8  10 o 0 16.3846  1.08584   -28.7884     -44.8626     6.24374      -13.9948     43.7566    -102.27      36.0673   90.3018      
1 1 1 9  8  11 o 0 18.4598  0.106512  -0.238515    -0.564414    0.187587     -0.308462    65.8777    -15.8394     13.407    -118.804     
1 1 1 9  8  12 o 0 13.9832  0.428571  7.78576      -10.9712     2.03627      6.23068      46.6965    -120.597     30.3827   139.628      
1 1 1 9  8  13 o 0 42.3814  1.23179   31.955       2.42508      -10.6098     -0.881168    149.126    42.3313      20.8174   -157.897     
1 1 1 9  8  14 o 0 22.9662  1.45288   1.65898      -91.9878     20.3712      0.990334     82.7666    -94.5536     19.4745   4.67674      
1 1 1 9  8  15 o 0 9.67804  0.216748  -4.77057     -1.60535     -2.54016     -2.1287      40.0643    -102.309     16.4068   -172.693     
1 1 1 9  8  16 o 0 15.8335  0.96082   6.79486      7.32687      0.0450188    -1.99591     82.9608    51.5069      44.0611   50.762       
1 1 1 9  8  17 o 0 10.6468  0.441845  -0.845283    0.798814     0.104657     0.450357     48.933     63.8651      20.9719   81.0052      
1 1 1 9  8  18 o 0 18.0322  1.0904    2.51602      -4.30589     0.871415     0.914223     77.6085    -42.4617     16.46     -36.106      
1 1 1 9  9  0  o 0 26.0595  0.184797  -1.87498e-17 -0.102069    0            0            97.6012    -90          9.63618   90           
1 1 1 9  9  1  o 0 32.5294  0.153449  3.61242      2.92489      -3.11062     -7.51591     119.326    108.64       58.6126   23.221       
1 1 1 9  9  2  o 0 29.8859  0.997532  14.3691      47.1405      17.4583      -11.2634     98.7011    5.73421      78.9118   -91.5215     
1 1 1 9  9  3  o 0 46.4035  0.723138  30.3986      -6.29437     -14.4178     7.28057      181.035    49.4242      57.0012   117.352      
1 1 1 9  9  4  o 0 44.3539  1.59107   -6.31615     66.0487      14.1865      3.14158      205.53     89.0025      67.6577   94.5882      
1 1 1 9  9  5  o 0 18.0675  0.509991  14.1341      -7.69492     -3.83221     6.13788      29.5339    68.9279      110.894   173.042      
1 1 1 9  9  6  f 1 13.2969  0.10673   -1.26184     -2.58077     1.50292      -1.69806     67.9359    -68.1384     87.5587   -113.312     
1 1 1 9  9  7  o 0 35.6463  0.799001  -25.0367     -3.22252     -9.68862     -2.18196     154.301    -124.344     34.6687   -116.533     
1 1 1 9  9  8  o 0 37.9483  1.06558   -1.23864     46.0527      19.0173      0.244793     191.717    143.7        95.6132   127.076      
1 1 1 9  9  9  o 0 36.7706  1.28538   -63.435      3.63492      -18.4791     2.65667      162.743    -149.888     45.8795   -167.119     
1 1 1 9  9  10 o 0 39.9854  1.13791   9.76772      31.0696      4.16283      -3.06385     192.713    95.0098      89.1917   73.2663      
1 1 1 9  9  11 f 1 19.4501  0.119169  -0.491992    0.376431     0.402404     1.22886      75.7882    -152.609     8.33065   -136.183     
1 1 1 9  9  12 o 0 21.3419  0.921788  14.5696      -26.5615     3.99659      6.04481      70.6676    -47.9922     22.9359   178.522      
1 1 1 9  9  13 o 0 13.0524  1.1282    -71.0483     -0.693488    -22.0421     -0.628351    38.5817    -168.042     12.521    1.79141      
1 1 1 9  9  14 o 0 29.2139  1.41236   2.84459      -31.3475     8.67079      1.07711      131.651    -47.7614     35.7289   -90.0561     
1 1 1 9  9  15 o 0 13.5448  0.632379  12.6211      0.576881     -6.29042     -0.259702    57.1337    -56.4797     7.81277   -86.6823     
1 1 1 9  9  16 o 0 21.756   0.541081  0.330534     -0.613429    0.174338     -0.0120384   78.0162    -43.4693     16.4146   133.938      
1 1 1 9  9  17 o 0 27.051   1.16568   -1.56218     -0.151118    -0.122886    0.021807     126.037    -163.913     39.7759   -164.629     
1 1 1 9  10 0  o 0 23.7065  0.165462  -2.101e-17   -0.114373    0            0            93.514     90           8.85117   -90          
1 1 1 9  10 1  o 0 13.9053  0.710074  -35.872      5.53123      -10.4468     3.40284      63.5209    -179.774     35.2183   147.526      
1 1 1 9  10 2  o 0 61.4101  0.258622  0.729736     -7.167       8.99125      -0.566947    255.652    -13.3644     30.5746   -8.545       
1 1 1 9  10 3  o 0 36.4104  1.31087   71.0274      -3.96217     -25.5095     2.32154      167.169    -50.6799     61.1131   -81.5819     
1 1 1 9  10 4  o 0 47.5519  0.752471  -0.678137    26.1097      11.5932      1.28902      200.447    37.9324      33.8662   14.6511      
1 1 1 9  10 5  o 0 2.44122  0.268695  -5.33776     3.65389      -1.48599     3.90287      30.4457    150.845      53.4233   152.448      
1 1 1 9  10 6  o 0 29.4309  0.205753  -2.25101     -2.18145     -0.0165254   -0.420295    97.574     -171.674     32.6571   -11.6755     
1 1 1 9  10 7  o 0 18.077   0.596626  -32.5848     -9.95638     -12.092      -8.47011     45.3644    142.959      48.3423   -34.3392     
1 1 1 9  10 8  o 0 37.8894  0.238201  0.84216      8.50481      15.1794      -6.46792     139.561    160.39       16.274    20.8542      
1 1 1 9  10 9  o 0 21.9789  0.133165  -0.959549    0.74219      -19.6161     9.28379      51.7204    93.4944      75.9865   -127.725     
1 1 1 9  10 10 o 0 17.0984  0.899368  -15.043      42.1632      10.0495      7.98181      71.2506    103.601      20.4526   117.21       
1 1 1 9  10 11 o 0 36.321   0.935515  -0.896013    18.1003      5.44995      0.828559     124.502    83.5069      24.1286   -80.5144     
1 1 1 9  10 12 o 0 23.032   0.667958  10.2046      16.1551      2.62421      -5.05874     85.2927    29.7516      1.8682    -48.9496     
1 1 1 9  10 13 o 0 42.1456  0.271152  4.87513      0.485841     -5.52736     -5.20834     189.636    -57.5503     34.0442   -68.6193     
1 1 1 9  10 14 o 0 10.9948  1.32723   9.05997      -36.8994     9.15364      4.56859      54.0367    -67.4371     25.0734   -83.8989     
1 1 1 9  10 15 o 0 6.87883  1.14882   -20.3617     5.59635      -3.92863     2.40916      4.29162    136.692      45.8393   -5.58709     
1 1 1 9  10 16 o 0 4.34741  0.359972  0.0557313    0.0345416    0            0            11.8685    92.9354      51.0221   95.133       
1 1 1 9  10 17 o 0 10.9727  0.266838  -0.224071    0.101497     0            0            50.1949    122.02       22.8556   125.037      
1 1 1 9  11 0  o 0 10.6724  0.11586   -7.0485e-18  -0.0383702   0            0            41.5123    -90          13.3783   90           
1 1 1 9  11 1  o 0 27.3469  1.00004   19.0497      -22.1156     0.880698     6.816        95.1025    -64.3585     24.4576   89.1951      
1 1 1 9  11 2  o 0 32.1959  0.65914   2.11157      -26.8988     13.1985      2.73952      160.113    -143.773     73.1118   -125.992     
1 1 1 9  11 3  o 0 7.86096  0.271592  -15.0245     1.45098      -16.2274     3.49839      26.1942    179.911      67.1836   119.854      
1 1 1 9  11 4  f 1 27.4672  0.922582  17.1835      34.4143      7.47615      -10.4289     117.818    92.5576      33.5898   130.507      
1 1 1 9  11 5  o 0 31.4853  0.657709  10.4134      14.1334      3.50279      -8.92302     129.953    -3.59085     40.9398   -65.2912     
1 1 1 9  11 6  o 0 40.5629  0.998427  18.392       -4.01078     -5.18673     2.71344      162.198    34.8147      23.4106   -24.345      
1 1 1 9  11 7  f 1 16.7201  1.39638   -39.3816     37.1567      -0.619973    9.17864      67.7372    134.565      11.1448   95.4778      
1 1 1 9  11 8  o 0 24.4274  0.78477   7.46225      -37.9248     15.0953      5.76087      111.332    -24.1914     51.4159   14.9966      
1 1 1 9  11 9  o 0 20.1594  0.529993  -20.3836     -6.99108     -12.5401     -10.6321     62.3124    114.52       52.7419   1.57377      
1 1 1 9  11 10 o 0 20.7677  0.688731  27.2581      21.844       -3.67591     -19.1317     80.5167    -25.0545     7.88524   -81.07       
1 1 1 9  11 11 f 1 14.3571  0.475279  -3.71207     -14.612      6.85922      -3.57896     34.659     -49.3641     38.6547   149.227      
1 1 1 9  11 12 o 0 31.3549  0.198904  -7.19337     2.5867       -4.26685     5.98425      131.085    -130.673     10.6474   166.442      
1 1 1 9  11 13 o 0 15.7005  0.772175  14.098       -5.21149     -4.02622     3.12221      50.9399    -57.983      23.6085   130.635      
1 1 1 9  11 14 o 0 27.0283  0.813145  -0.968231    -6.79096     1.99413      0.068641     95.8249    -152.903     30.3365   -7.19584     
1 1 1 9  11 15 o 0 4.18009  0.650149  -3.08204     -2.59116     -0.390926    -1.49591     5.98976    -121.928     13.777    30.1796      
1 1 1 9  12 0  o 0 20.1494  0.162461  7.68896e-17  0.251141     0            0            77.5609    -90          48.2484   -90          
1 1 1 9  12 1  o 0 6.08487  0.769045  -11.2196     -24.1371     4.1617       -4.89376     19.7499    -75.7584     34.0948   -1.68516     
1 1 1 9  12 2  o 0 12.6606  0.342775  -8.67685     -10.5171     1.75865      -8.10885     28.1221    -158.9       64.5309   -50.3291     
1 1 1 9  12 3  o 0 12.0403  0.221681  -10.4138     1.95182      -8.28242     2.91595      51.838     106.394      19.2302   158.125      
1 1 1 9  12 4  o 0 5.53878  0.477785  15.3703      -14.642      -0.656078    11.567       19.6482    -56.0794     28.3779   6.32643      
1 1 1 9  12 5  o 0 25.3799  1.06762   16.357       -41.2214     10.803       9.71414      105.736    -44.9351     30.0203   -1.48253     
1 1 1 9  12 6  o 0 9.72873  0.092132  3.71994      -0.528863    -17.4845     3.39755      36.0947    67.5704      29.5135   47.8093      
1 1 1 9  12 7  o 0 40.1229  1.28804   29.1503      42.4606      4.01305      -9.4242      143.916    35.1544      52.4146   142.093      
1 1 1 9  12 8  o 0 43.3235  0.318114  3.01257      3.79734      1.91593      -3.57893     185.82     -13.0649     41.6785   -14.6048     
1 1 1 9  12 9  o 0 21.2873  0.754663  -26.0664     17.4724      -3.53771     9.12529      79.2564    -178.931     40.4849   95.9111      
1 1 1 9  12 10 o 0 14.6556  0.995632  -20.6141     11.4976      -4.40142     6.55571      67.1035    114.385      15.4013   120.537      
1 1 1 9  12 11 f 1 31.8696  0.222197  -0.936021    -1.31592     9.83128      2.28507      122.481    -171.869     18.6321   -11.1818     
1 1 1 9  12 12 o 0 16.0377  0.848629  -14.7663     -3.48086     -5.35745     -3.07071     63.752     -127.415     14.4599   -39.5011     
1 1 1 9  12 13 o 0 33.6245  1.10003   -4.39825     -4.53063     0.622482     -1.48002     131.493    -163.697     8.74821   16.0508      
1 1 1 9  12 14 o 0 8.56896  1.23625   2.79654      -5.79194     0.541984     0.795768     29.6179    -67.6863     8.78903   57.0079      
1 1 1 9  13 0  f 1 22.709   0.205105  6.39435e-17  0.208855     0            0            89.7844    90           23.0932   -90          
1 1 1 9  13 1  o 0 43.4093  0.998949  2.06996      -27.8194     10.4404      0.878842     184.791    -45.436      34.2521   -17.567      
1 1 1 9  13 2  o 0 7.02083  0.175006  -3.79184     2.26518      -1.55389     2.66466      14.4045    81.2083      19.4762   -75.3104     
1 1 1 9  13 3  o 0 25.9027  0.154421  -0.35735     0.100433     -0.824984    -0.187308    84.4422    64.1262      35.4861   -152.119     
1 1 1 9  13 4  o 0 8.93866  0.847338  38.7834      5.81066      -8.11793     -2.54237     49.8181    12.6719      36.6366   33.0417      
1 1 1 9  13 5  o 0 28.3476  0.456575  -9.28458     -31.7977     17.613       -10.1398     137.126    -167.508     68.3      -136.228     
1 1 1 9  13 6  o 0 6.25573  0.789792  51.7756      6.05006      -22.5316     -5.48121     17.6018    -52.4015     10.0163   -170.039     
1 1 1 9  13 7  o 0 25.3119  0.415775  -0.0535231   13.3724      11.809       -0.761725    91.5638    18.9903      36.481    118.988      
1 1 1 9  13 8  o 0 32.7582  0.777018  -4.74686     2.19401      -0.451988    0.678967     161.769    -168.177     51.3221   -176.944     
1 1 1 9  13 9  o 0 9.13662  0.168608  0.700675     1.32156      1.0437       -1.10852     41.3853    135.479      15.1825   140.844      
1 1 1 9  13 10 o 0 30.9043  1.18126   -21.4879     -6.70016     -6.14205     -5.13171     142.92     149.737      33.7208   169.854      
1 1 1 9  13 11 o 0 9.81403  0.623541  -0.171449    -7.1755      3.41774      -0.634431    42.0481    -45.365      25.6646   -113.92      
1 1 1 9  13 12 o 0 19.8413  0.203754  4.99625      0.925441     -4.00151     0.352177     88.8289    63.396       25.682    104.813      
1 1 1 9  13 13 o 0 13.3762  0.194581  0.459986     -0.576646    0.557963     0.276088     68.4951    20.7347      36.2679   8.02093      
1 1 1 9  14 0  o 0 28.3267  0.260595  -5.91177e-17 -0.321822    0            0            111.935    -90          21.6943   90           
1 1 1 9  14 1  f 1 10.4137  0.328822  4.3347       -9.0212      6.83871      7.91271      46.135     35.8423      46.2164   97.0276      
1 1 1 9  14 2  o 0 17.981   0.538816  17.4789      -6.48364     -4.60742     3.76919      70.9509    -30.9141     8.79487   -67.1099     
1 1 1 9  14 3  o 0 20.8881  0.140663  -0.0383869   0.104013     -1.23317     -0.84213     87.0761    -81.1891     16.6782   -54.2676     
1 1 1 9  14 4  o 0 28.9476  0.569878  4.0154       0.902635     -2.46514     -0.512366    149.471    -55.5804     53.6567   -57.1031     
1 1 1 9  14 5  o 0 28.0533  0.199382  -0.273137    -5.53268     5.54198      0.987888     121.813    -161.456     6.64998   -136.204     
1 1 1 9  14 6  o 0 21.3632  0.94291   19.1029      -4.40862     -8.03453     4.7133       120.827    -68.4535     65.7348   -81.428      
1 1 1 9  14 7  f 1 10.3999  0.862196  -3.35207     14.9101      4.80104      2.07721      49.2699    74.1587      24.0582   116.44       
1 1 1 9  14 8  o 0 8.11093  0.132759  0.63049      -0.44329     -0.111513    1.8088       37.9032    39.8565      22.8019   84.4717      
1 1 1 9  14 9  o 0 7.96941  0.323296  0.637937     0.83202      0.223755     -0.34066     28.2887    48.4692      2.65926   -29.8376     
1 1 1 9  14 10 o 0 32.9587  0.612046  3.17778      -1.04435     -1.66571     -0.203293    143.905    32.5832      18.2185   34.7663      
1 1 1 9  14 11 o 0 8.51678  1.46811   2.66532      -16.6696     4.22762      1.08925      21.4798    -71.5138     24.0771   80.3037      
1 1 1 9  15 0  o 0 14.8492  0.192777  -2.1527e-17  -0.117187    0            0            64.8338    -90          3.26156   -90          
1 1 1 9  15 1  o 0 28.566   0.713101  -6.25485     -11.8355     2.55729      -3.0033      111.386    -104.37      22.6119   83.0575      
1 1 1 9  15 2  o 0 23.2991  0.201044  0.973651     1.07171      1.78612      -2.52068     109.167    -20.9933     19.6986   -19.0561     
1 1 1 9  15 3  f 1 12.2563  0.658028  -8.40334     0.459728     -1.95998     0.135253     59.8088    169.291      21.7485   175.829      
1 1 1 9  15 4  o 0 19.126   0.179491  -1.24884     2.49726      1.05727      3.29533      107.594    -157.24      54.5527   -155.926     
1 1 1 9  15 5  f 1 21.8628  1.3103    -0.483751    -18.9383     3.30027      -0.300939    104.714    -95.6166     26.766    -85.7592     
1 1 1 9  15 6  o 0 16.0235  0.186135  -1.8836      0.181112     -1.90179     -1.36529     54.7325    119.673      24.4089   -43.2898     
1 1 1 9  15 7  o 0 9.53207  0.27825   -1.01769     -2.09672     0.764137     -2.4918      50.6       -49.9353     25.4345   -38.8253     
1 1 1 9  15 8  o 0 14.7756  0.595352  -2.32567     -3.3405      0.778767     -1.12805     53.3289    -146.498     13.8031   60.876       
1 1 1 9  15 9  o 0 4.95139  0.184813  -0.369861    -0.0827759   -0.785682    0.252549     5.12405    -161.273     8.69802   -163.802     
1 1 1 9  16 0  o 0 16.3646  0.364544  1.88148e-17  0.0614537    0            0            71.3303    90           20.7423   -90          
1 1 1 9  16 1  o 0 19.8176  1.11983   5.21813      -3.576       -0.579626    0.879706     80.5297    -6.79641     14.6567   -126.898     
1 1 1 9  16 2  o 0 9.50474  0.629932  -1.62662     4.17081      1.0276       1.3102       39.9993    74.8416      3.80162   67.7262      
1 1 1 9  16 3  o 0 20.6091  0.213711  1.53778      -0.872282    -2.1729      0.0464668    98.5376    -84.3549     23.5431   -73.454      
1 1 1 9  16 4  o 0 14.5602  0.263057  0.348346     -0.135112    0            0            61.8925    99.4084      5.58343   69.6486      
1 1 1 9  16 5  o 0 7.59605  0.248452  0.122154     -0.0896962   0            0            27.2803    73.0997      8.57832   59.1716      
1 1 1 9  16 6  o 0 6.7082   0.258197  -0.162616    -0.227908    0            0            15.9806    105.914      4.09762   167.99       
1 1 1 10 0  0  f 1 28.8548  0.447018  0.111277     0            0            0            85.9879    180          12.6456   -180         
1 1 1 10 0  1  o 0 24.4377  0.221008  -2.40993e-18 -0.013119    0            0            89.3951    90           44.8243   -90          
1 1 1 10 0  2  f 1 67.5226  0.481576  0.0986939    0            0            0            251.116    0            7.14224   0            
1 1 1 10 0  3  o 0 19.0368  0.184681  -3.13411e-19 -0.00170613  0            0            21.2186    90           7.24371   90           
1 1 1 10 0  4  o 0 21.3214  0.195191  -0.0689628   8.44551e-18  0            0            79.2055    0            34.2345   180          
1 1 1 10 0  5  o 0 56.5544  0.411638  3.57085e-17  0.116633     0            0            212.279    90           135.912   90           
1 1 1 10 0  6  f 1 68.66    0.447841  -0.275663    3.3759e-17   0            0            257.923    0            21.2621   0            
1 1 1 10 0  7  o 0 10.5736  0.144601  2.84515e-18  0.00929296   0            0            12.2402    -90          2.32735   90           
1 1 1 10 0  8  o 0 26.3363  0.195982  -0.0964293   1.18092e-17  0            0            98.6376    -180         19.9098   180          
1 1 1 10 0  9  o 0 63.3806  0.391231  -2.45063e-17 -0.133406    0            0            236.616    -90          4.34502   -90          
1 1 1 10 0  10 o 0 26.9333  0.193531  0.162317     0            0            0            100.062    0            14.9982   0            
1 1 1 10 0  11 o 0 29.8127  0.241225  -1.34257e-17 -0.0730859   0            0            115.766    90           1.10409   -90          
1 1 1 10 0  12 o 0 4.06202  0.243457  0.0304911    0            0            0            0.316569   180          5.70346   -0           
1 1 1 10 0  13 o 0 29.858   0.234272  -2.34282e-17 -0.127537    0            0            114.177    -90          12.6012   90           
1 1 1 10 0  14 o 0 25.6144  0.214865  -0.0719673   8.81345e-18  0            0            97.0574    -180         11.3257   180          
1 1 1 10 0  15 o 0 21.9682  0.187306  3.47197e-18  0.0113403    0            0            82.4103    -90          59.7456   90           
1 1 1 10 0  16 o 0 42.8334  0.280645  -0.276777    3.38954e-17  0            0            158.951    0            35.7973   0            
1 1 1 10 0  17 o 0 11.7983  0.13408   3.10802e-17  0.101516     0            0            42.9353    90           7.29444   90           
1 1 1 10 0  18 o 0 21.2391  0.191309  -0.316468    3.87561e-17  0            0            85.1379    180          13.9058   -180         
1 1 1 10 0  19 o 0 39.1778  0.500236  4.97784e-17  0.162589     0            0            155.027    -90          3.44096   90           
1 1 1 10 1  0  o 0 44.9411  0.352139  -0.0839528   1.02813e-17  0            0            163.312    0            67.6209   2.18924e-14  
1 1 1 10 1  1  o 0 71.3476  1.63961   44.9567      0.914478     -13.4922     -0.90787     281.652    -35.2237     53.9891   -5.61593     
1 1 1 10 1  2  o 0 45.7248  0.644619  -5.65408     -0.269909    -1.15732     -0.132447    182.321    -146.279     40.8069   -176.588     
1 1 1 10 1  3  f 1 35.1207  0.183497  0.303122     -0.60252     0.0131321    0.0216664    97.1089    -97.7346     58.0944   70.9096      
1 1 1 10 1  4  o 0 52.1449  0.740522  10.2698      -10.2405     0.113459     3.7374       174.868    -77.3854     49.2916   53.1451      
1 1 1 10 1  5  o 0 85.9179  1.46733   -26.4293     0.697941     -10.0073     -0.145184    365.924    -143.134     96.8136   -129.884     
1 1 1 10 1  6  o 0 28.3775  0.314756  0.629569     4.55211      1.54835      -0.388953    67.3851    35.7961      74.25     -158.266     
1 1 1 10 1  7  o 0 98.2797  1.21617   9.42051      1.16158      -2.30855     -0.217384    441.812    -67.2058     152.98    -57.5119     
1 1 1 10 1  8  o 0 20.328   0.477175  -6.38369     0.0213813    -1.77726     0.0564298    34.553     158.968      82.4789   -52.488      
1 1 1 10 1  9  f 1 58.7177  0.559972  -1.46337     0.142329     -0.767605    0.600329     236.779    136.353      40.8341   131.128      
1 1 1 10 1  10 o 0 23.8626  0.547255  7.34406      -15.6929     2.80327      3.50469      107.991    -87.1287     56.1995   -56.2323     
1 1 1 10 1  11 o 0 6.02549  0.215458  7.97041      -0.589331    -6.90807     0.976692     11.475     -9.85412     8.69034   -8.698       
1 1 1 10 1  12 o 0 40.0735  0.770118  -1.11765     -12.2672     3.04883      -0.384763    162.413    -84.9422     23.4432   -98.6219     
1 1 1 10 1  13 o 0 39.2445  0.93722   -17.357      -4.42071     -2.66973     -1.27463     185.303    171.5        76.683    -175.595     
1 1 1 10 1  14 o 0 33.9503  0.428996  -5.14794     -1.13995     -1.44304     -0.832547    154.659    -146.775     57.0283   -146.722     
1 1 1 10 1  15 o 0 25.1685  0.537232  -7.90195     2.9012       -1.78387     1.40214      82.289     -177.347     20.3098   13.4638      
1 1 1 10 1  16 o 0 10.7896  0.397663  6.75279      -7.17543     0.220436     2.78407      16.2528    -47.7451     55.2095   72.6841      
1 1 1 10 1  17 f 1 4.88331  1.00206   -23.9377     0.881114     -8.62451     0.515362     6.56668    161.38       14.8986   -2.77539     
1 1 1 10 1  18 o 0 26.707   0.658658  -4.59196     -9.48725     1.01019      -1.50148     105.773    -96.1146     8.75557   178.874      
1 1 1 10 1  19 o 0 7.15306  0.25845   -0.67825     -0.0398369   -0.707081    -0.362927    26.553     136.022      13.1743   121.051      
1 1 1 10 2  0  o 0 63.5177  0.399726  -0.404438    4.95294e-17  0            0            233.004    180          26.3289   -1.91598e-13 
1 1 1 10 2  1  o 0 52.0859  0.888182  -8.48005     15.8433      2.16887      3.48512      210.368    127.891      46.7942   113.595      
1 1 1 10 2  2  o 0 25.3648  0.839713  -3.63423     29.5562      7.83733      1.91507      137.857    86.3658      110.15    105.887      
1 1 1 10 2  3  o 0 25.4836  0.842609  8.06558      34.244       11.6871      -5.73231     79.6272    24.4504      51.4018   -79.8244     
1 1 1 10 2  4  o 0 28.5252  0.980549  6.14085      37.3563      12.6683      -4.15535     105.331    62.2359      34.9296   33.456       
1 1 1 10 2  5  o 0 63.5917  0.320922  -2.68233     -1.88235     -1.27787     -1.92983     240.789    -54.0137     77.4816   -130.049     
1 1 1 10 2  6  o 0 51.3503  0.342337  1.01303      -6.06698     6.93559      1.42688      159.781    -162.197     64.2543   -0.369932    
1 1 1 10 2  7  o 0 29.3364  0.357359  2.19676      -3.53623     0.481437     1.00904      99.2539    -15.6443     21.8729   -143.592     
1 1 1 10 2  8  o 0 76.3421  0.373885  -0.186188    0.660402     -0.0384117   0.448059     312.216    178.882      58.8119   -179.934     
1 1 1 10 2  9  o 0 8.91659  0.435354  -7.79823     -17.5999     7.25163      -7.84783     16.9888    113.883      59.7568   44.7146      
1 1 1 10 2  10 o 0 15.3354  0.219354  -2.0791      -8.33447     5.29956      -2.60082     51.4789    -19.6201     40.8397   67.1777      
1 1 1 10 2  11 o 0 15.4764  0.442417  12.0656      5.70558      -3.23525     -3.81911     81.3998    -2.07094     78.7501   37.8825      
1 1 1 10 2  12 o 0 66.7767  0.912823  -1.33499     10.594       1.95678      0.260712     267.817    86.9172      27.4707   101.703      
1 1 1 10 2  13 o 0 39.6362  0.405858  -2.5748      6.11324      2.71435      4.10037      153.689    174.393      23.2127   -118.034     
1 1 1 10 2  14 o 0 37.3325  0.183684  0.763124     -0.0453414   -0.890148    -0.51304     140.256    84.038       4.13104   149.828      
1 1 1 10 2  15 o 0 30.2533  0.629083  2.56749      14.9507      4.70549      -1.50059     124.174    123.588      27.3466   102.825      
1 1 1 10 2  16 f 1 15.1572  0.327344  3.66676      10.0388      6.3739       -5.00729     56.7424    19.7826      56.3003   92.5927      
1 1 1 10 2  17 f 1 12.3992  0.334716  3.22279      0.364219     -1.33729     -0.455364    38.2748    53.3833      18.4563   -129.713     
1 1 1 10 2  18 o 0 22.3534  0.559472  -1.01373     7.53531      4.70936      2.00811      94.1187    161.214      26.1757   -141.269     
1 1 1 10 2  19 o 0 8.55746  0.231028  -0.661899    1.29526      0.977385     0.696424     20.3165    178.467      23.2883   -3.62022     
1 1 1 10 2  20 o 0 18.2455  1.25815   -2.34631     -0.0182179   -0.186973    -0.0343679   73.0191    105.238      16.4748   165.064      
1 1 1 10 3  0  f 1 83.1715  0.498378  0.128548     0            0            0            304.912    0            80.1674   5.82592e-14  
1 1 1 10 3  1  o 0 32.1335  1.29643   70.9353      13.1814      -21.2661     -8.0287      147.052    41.6535      64.6576   32.3459      
1 1 1 10 3  2  o 0 20.8407  1.15442   73.8086      5.31742      -21.1185     -3.11182     80.8963    7.02232      32.9793   -40.6437     
1 1 1 10 3  3  o 0 70.867   0.340361  -0.0380876   -0.121384    0.25548      0.500069     267.893    -1.38757     19.6664   30.1386      
1 1 1 10 3  4  o 0 43.313   0.279214  4.8986       -2.45241     -12.7304     12.4645      155.971    -116.079     59.7863   151.535      
1 1 1 10 3  5  f 1 55.8257  1.36124   -30.4673     -0.712354    -6.27787     -0.0636136   213.626    -166.431     18.1189   162.072      
1 1 1 10 3  6  o 0 16.01    0.504592  -3.95808     -8.74284     1.89898      -2.09392     66.0514    -99.1864     32.1819   -133.813     
1 1 1 10 3  7  o 0 33.1819  0.223978  -2.43005     -1.60066     -1.16663     -2.1984      144.222    126.573      66.2941   166.763      
1 1 1 10 3  8  o 0 41.5925  1.17667   31.7984      -2.42244     -9.30893     1.69277      170.947    -38.9184     44.4609   -6.86277     
1 1 1 10 3  9  o 0 14.6049  0.693254  -12.8992     18.0296      1.51083      4.61737      71.5095    123.141      43.9749   108.578      
1 1 1 10 3  10 o 0 35.329   0.778354  14.1736      -10.7513     -1.35755     5.42501      110.466    0.565853     52.9827   -154.565     
1 1 1 10 3  11 o 0 32.3064  0.178387  -0.0642398   0.136199     -1.00405     0.545519     140.401    80.4637      39.1271   74.1912      
1 1 1 10 3  12 o 0 77.2271  0.586181  2.60544      4.05819      0.511959     -0.78782     346.137    40.3537      102.897   40.5777      
1 1 1 10 3  13 o 0 21.632   0.136964  -0.595131    -2.1523      1.86579      -0.722235    101.901    177.298      48.066    -162.017     
1 1 1 10 3  14 o 0 18.299   1.03992   -52.1778     -3.8943      -14.0345     -1.9264      60.7401    -160.054     16.7908   63.9494      
1 1 1 10 3  15 o 0 28.8848  0.16918   -3.12917     3.85155      0.806297     2.71304      112.762    -161.362     22.5344   147.012      
1 1 1 10 3  16 o 0 18.7918  0.263957  -8.73471     2.64253      -5.42089     4.16738      62.7287    -128.365     11.6733   38.2568      
1 1 1 10 3  17 o 0 27.9816  0.436975  4.73162      -0.88216     -2.3597      0.408763     109.986    -64.9896     3.14003   127.503      
1 1 1 10 3  18 o 0 26.1058  0.563951  10.7081      5.1264       -2.39945     -2.38994     105.093    61.1948      5.17735   29.1356      
1 1 1 10 3  19 o 0 13.1989  0.650164  1.50516      1.51675      0.11505      -0.503196    50.4394    21.0814      1.90182   48.3399      
1 1 1 10 3  20 o 0 17.2634  0.464092  -3.44165     0.607521     -2.32392     -0.112538    51.8316    106.222      35.188    -116.1       
1 1 1 10 4  0  o 0 46.0435  0.342765  0.124298     0            0            0            168.857    0            66.6913   1.91063e-14  
1 1 1 10 4  1  o 0 61.6914  0.806961  5.00138      -17.0095     6.50531      4.73975      260.892    -30.6119     89.2752   -0.894303    
1 1 1 10 4  2  o 0 56.3345  0.617404  5.33278      -5.04148     -0.0225769   2.49874      212.25     22.8271      79.3839   -51.4749     
1 1 1 10 4  3  o 0 53.7115  0.84653   -5.86157     -32.515      18.5942      -5.95886     164.221    -162.974     67.3436   10.5027      
1 1 1 10 4  4  o 0 68.0019  0.295726  -0.50127     0.117381     0.985328     -2.68946     277.565    -78.5122     63.8581   -49.0963     
1 1 1 10 4  5  o 0 68.3237  0.62252   5.44299      6.39121      0.252514     -3.03627     240.617    104.563      25.9969   -48.5203     
1 1 1 10 4  6  o 0 46.9512  0.754751  -6.01688     9.12246      1.11246      2.26838      216.793    145.725      91.0003   142.448      
1 1 1 10 4  7  o 0 22.2618  0.400415  -2.06051     12.9165      6.63203      2.25627      82.8525    32.0367      38.1049   -44.6102     
1 1 1 10 4  8  o 0 56.0636  0.891312  -11.0601     -4.04606     -2.30686     -1.71166     169.564    176.882      73.1706   -10.1365     
1 1 1 10 4  9  o 0 24.6138  1.35842   -16.99       -77.3178     22.8886      -10.9559     61.3575    -81.4866     75.4833   149.6        
1 1 1 10 4  10 o 0 9.28084  0.292954  5.49328      2.12962      -1.22289     -1.13261     34.7136    146.417      130.675   159.579      
1 1 1 10 4  11 o 0 35.8482  0.187059  1.17674      0.384761     -0.967226    -1.55222     119.058    -60.3064     42.3075   76.8622      
1 1 1 10 4  12 o 0 16.793   0.246407  2.14675      2.17226      -0.0316282   -1.02007     38.4079    74.9832      46.2158   -107.814     
1 1 1 10 4  13 o 0 12.9117  1.28861   7.99208      -61.0788     14.5773      4.03211      49.058     -84.8917     4.7879    -104.837     
1 1 1 10 4  14 o 0 34.8345  0.256699  -3.47695     -0.437546    -2.81469     -1.36626     135.591    119.696      12.6756   115.314      
1 1 1 10 4  15 o 0 14.8796  0.767668  1.00648      34.7137      12.7561      -0.877817    30.4299    36.3937      49.9003   -121.687     
1 1 1 10 4  16 o 0 7.90233  0.469712  8.24433      3.95686      -1.35366     -1.6362      16.3128    24.3357      21.3288   -136.376     
1 1 1 10 4  17 o 0 22.5967  0.151177  -0.297258    0.14587      -0.0964352   0.070158     111.302    152.039      46.5293   151.567      
1 1 1 10 4  18 f 1 15.9534  0.480783  -3.70337     1.98414      -0.424219    0.779132     67.8024    177.358      13.5338   161.388      
1 1 1 10 4  19 o 0 10.1728  0.775479  1.24333      -7.16558     2.93795      0.660596     26.3967    -36.5728     27.995    98.6633      
1 1 1 10 5  0  o 0 43.21    0.323877  -0.0226128   2.76927e-18  0            0            158.661    180          6.65529   -5.87214e-13 
1 1 1 10 5  1  f 1 65.1071  0.304082  1.02749      0.360178     0.018674     -2.29889     289.962    14.6603      108.15    3.38472      
1 1 1 10 5  2  o 0 68.5923  0.325974  -8.6386      0.663408     -14.4142     -0.714211    236.796    103.358      88.184    -2.00259     
1 1 1 10 5  3  o 0 62.939   0.294124  0.689609     -0.570728    2.26867      2.00318      272.5      -144.743     84.8479   -154.517     
1 1 1 10 5  4  o 0 33.1786  1.23197   -69.8382     14.7819      -24.4417     10.3769      158.889    135.464      126.726   -179.942     
1 1 1 10 5  5  o 0 39.8283  0.199678  -0.437259    0.207342     -0.024763    0.0487417    139.61     122.546      10.4406   -69.3275     
1 1 1 10 5  6  o 0 50.9801  0.755636  7.31544      4.49573      -0.502609    -1.16781     188.383    49.3218      13.6154   -25.7583     
1 1 1 10 5  7  o 0 21.1124  0.598207  8.75218      -19.1469     3.97199      4.68414      42.2833    -86.0335     142.611   -166.494     
1 1 1 10 5  8  o 0 22.5037  1.14475   90.0482      -12.6934     -29.0422     8.01981      68.5664    -47.6943     27.2567   136.595      
1 1 1 10 5  9  o 0 44.0354  0.883143  0.705771     -25.04       5.05268      0.4855       150.38     -99.7222     37.7417   59.8001      
1 1 1 10 5  10 o 0 10.2353  0.481825  20.2795      -5.87072     -7.02886     4.38403      18.2756    -34.4211     38.6207   103.735      
1 1 1 10 5  11 o 0 52.5282  0.576086  3.39649      0.377125     -1.26235     -0.157079    218.289    27.9468      37.2865   31.879       
1 1 1 10 5  12 o 0 42.0595  0.627246  9.44635      1.29195      -2.06186     -0.486137    152.725    60.7179      27.5416   -52.2196     
1 1 1 10 5  13 o 0 4.05904  0.158137  -0.266318    0.428661     1.35475      6.40259      9.22068    -39.7477     19.6728   -37.4744     
1 1 1 10 5  14 o 0 26.9102  0.152916  -8.19687     -0.0226417   -16.6808     -2.71346     137.074    103.354      75.6137   112.162      
1 1 1 10 5  15 o 0 25.4882  0.393811  1.78957      10.6691      3.37765      -1.01786     49.3109    36.8388      88.8409   -153.353     
1 1 1 10 5  16 o 0 22.5814  0.803134  7.69217      1.108        -1.64227     -0.316033    106.357    19.3277      34.4033   18.7203      
1 1 1 10 5  17 o 0 36.6277  0.213336  2.09244      -0.435802    -0.5575      -0.00895592  135.919    -84.0523     21.2201   68.8569      
1 1 1 10 5  18 o 0 9.11778  1.04743   8.14055      -0.304519    -1.74165     -0.0507343   30.2261    -14.3948     15.1086   100.104      
1 1 1 10 5  19 o 0 25.4089  1.53265   -0.376698    4.27803      0.418212     -0.0135854   100.406    122.734      8.07416   71.5021      
1 1 1 10 6  0  f 1 109.011  0.624786  0.323314     0            0            0            401.002    0            32.0958   2.35597e-13  
1 1 1 10 6  1  o 0 69.1799  0.29717   0.769336     -0.79323     7.1256       -0.0485731   265.148    7.66962      51.6295   -53.297      
1 1 1 10 6  2  o 0 91.0837  0.377909  1.09768      -0.480849    -2.4124      -0.416871    418.537    -79.8668     167.82    -79.6913     
1 1 1 10 6  3  o 0 49.1684  1.87449   9.962        88.0052      25.6036      -5.38052     163.165    52.208       36.1631   -145.386     
1 1 1 10 6  4  o 0 44.0662  0.372113  6.61783      -1.9956      -2.4506      1.37569      135.144    -74.985      56.5219   79.8989      
1 1 1 10 6  5  o 0 23.1911  0.212682  -0.117088    6.30669      3.49571      0.234302     49.8196    27.4008      69.4246   -135.584     
1 1 1 10 6  6  o 0 5.02314  0.529943  9.24486      11.3965      1.14575      -5.51008     29.4443    1.28573      58.6781   -26.7362     
1 1 1 10 6  7  o 0 20.9192  0.473623  -4.35923     -25.446      13.9419      -4.62703     80.6945    -28.2657     27.8152   38.6925      
1 1 1 10 6  8  o 0 51.6282  0.251017  -0.327568    0.846871     -4.06        -7.63813     199.951    118.71       56.8263   -158.63      
1 1 1 10 6  9  f 1 21.3074  1.16478   1.47372      63.4271      19.3262      -1.12272     93.3245    114.008      33.0769   82.2692      
1 1 1 10 6  10 o 0 9.58386  0.878097  21.6418      -36.4237     5.40441      9.80284      67.097     -58.1955     67.6076   -54.8291     
1 1 1 10 6  11 f 1 6.57749  0.0975894 0.263365     0.066007     -0.0853079   -0.0414572   4.59218    -9.14003     11.3265   25.2762      
1 1 1 10 6  12 o 0 27.8486  0.344159  -3.66458     -12.4388     10.8428      -8.4338      101.172    -33.007      7.25644   163.867      
1 1 1 10 6  13 o 0 33.2945  0.955983  -2.18318     -35.9775     11.0734      -1.78266     135.436    -60.3505     24.385    -49.4048     
1 1 1 10 6  14 o 0 10.9259  0.224576  -6.30672     -0.271416    -7.3127      -0.299102    67.1358    117.221      67.4599   137.859      
1 1 1 10 6  15 o 0 31.499   0.975536  6.90921      -23.6995     6.26438      3.70733      123.295    -48.0973     17.5199   -37.7622     
1 1 1 10 6  16 o 0 24.7121  0.153334  0.621943     -1.86526     1.53445      2.24315      108.033    -152.873     28.9126   -109.017     
1 1 1 10 6  17 o 0 23.8291  0.362857  -3.44182     -2.53282     -0.118608    -0.625387    97.8823    -105.144     11.9142   -147.561     
1 1 1 10 6  18 o 0 8.92624  0.619413  0.766809     1.55656      0.26961      -0.598355    22.9147    88.3281      19.0525   -104.998     
1 1 1 10 7  0  o 0 16.3615  0.145388  -0.0431425   5.28343e-18  0            0            49.945     0            15.4214   1.6169e-13   
1 1 1 10 7  1  o 0 20.917   0.120017  1.67481      -1.42588     -2.11701     7.66132      88.0289    -144.131     83.4911   156.134      
1 1 1 10 7  2  o 0 32.0847  0.162419  -7.96755     0.438233     -25.1994     5.68618      110.477    -114.213     64.2702   150.254      
1 1 1 10 7  3  o 0 71.189   0.325836  -1.85413     6.61542      3.4044       1.37733      322.628    -176.114     127.332   169.891      
1 1 1 10 7  4  o 0 33.4965  0.915073  -37.2722     -5.26597     -14.1462     -3.80131     141.588    -122.466     58.9473   -79.3921     
1 1 1 10 7  5  o 0 20.8347  0.169818  4.8054       0.669065     -18.2935     -1.99193     117.772    -85.6468     85.3598   -91.222      
1 1 1 10 7  6  o 0 10.5482  0.338137  -7.00502     8.19094      0.553864     3.75618      49.8659    129.903      37.7527   126.264      
1 1 1 10 7  7  o 0 25.899   0.138639  1.41204      -0.510826    -6.14664     22.6492      110.418    58.4574      35.5351   107.433      
1 1 1 10 7  8  o 0 12.7784  1.23134   63.822       -14.5103     -15.1085     7.34744      44.6218    -4.62666     17.2885   92.5822      
1 1 1 10 7  9  o 0 15.7034  0.988794  26.4983      46.3577      5.88503      -9.82213     54.9956    72.7288      60.4516   154.861      
1 1 1 10 7  10 o 0 42.8728  0.650913  -8.77492     -7.69255     -0.1339      -2.07803     189.788    -120.704     55.9532   -128.219     
1 1 1 10 7  11 o 0 20.4434  0.389214  -19.0118     -0.306839    -19.1823     0.0212434    62.8075    -117.616     46.8898   122.899      
1 1 1 10 7  12 o 0 20.4225  0.624121  -12.5972     9.6735       -1.15986     4.92467      59.4875    177.495      31.88     7.96403      
1 1 1 10 7  13 o 0 59.3889  1.08538   21.4185      -15.5933     -2.31593     5.35779      240.23     -64.3674     40.1662   -50.667      
1 1 1 10 7  14 f 1 28.7733  0.14532   3.22977      0.4032       -5.60803     -3.07043     110.502    102.391      34.5656   33.4075      
1 1 1 10 7  15 o 0 28.8142  0.641923  3.24248      3.30672      -0.727045    -3.42178     123.043    97.6419      23.1434   143.98       
1 1 1 10 7  16 o 0 5.1439   0.385704  1.46743      4.01981      0.982166     -0.788924    29.0467    70.5982      33.5497   96.1087      
1 1 1 10 7  17 f 1 16.1157  1.83723   12.9732      1.15677      -2.60514     -0.121606    93.7946    8.63004      65.7216   10.4566      
1 1 1 10 7  18 o 0 10.2876  0.585345  1.92599      -0.448576    -0.711953    0.629651     39.4456    34.508       3.44363   36.4449      
1 1 1 10 8  0  o 0 39.965   0.278301  -0.500184    6.12549e-17  0            0            147.671    0            5.40399   180          
1 1 1 10 8  1  o 0 16.1159  0.239923  9.24175      10.047       0.75463      -12.3639     58.3944    -32.1688     12.542    -122.949     
1 1 1 10 8  2  o 0 16.3415  0.787614  -26.1653     -22.4089     -1.78497     -12.3068     29.7719    -103.993     49.7945   40.5107      
1 1 1 10 8  3  o 0 60.6621  0.633318  -1.19926     -6.56546     10.0499      -0.484924    224.934    -168.75      45.185    109.329      
1 1 1 10 8  4  o 0 22.5075  0.115527  -1.01483     3.17993      9.10904      9.2437       113.287    -155.873     58.1434   -135.844     
1 1 1 10 8  5  o 0 27.9122  0.253342  13.5183      -6.9477      -5.08324     6.43598      149.225    -85.8974     87.255    -76.0142     
1 1 1 10 8  6  o 0 30.0977  1.96645   -27.0142     -114.268     26.4067      -13.5139     126.256    -98.2546     25.802    -105.204     
1 1 1 10 8  7  o 0 12.3723  0.65078   -19.6383     -20.3792     0.281552     -10.7163     35.5148    -96.9162     14.3876   84.1077      
1 1 1 10 8  8  o 0 53.0894  0.393967  12.6253      10.1163      -0.601942    -5.60503     215.443    -5.05009     25.1898   -3.79646     
1 1 1 10 8  9  o 0 13.6847  0.588846  6.30169      -5.7736      -0.133799    1.95684      61.7201    -49.2201     28.2405   -35.4404     
1 1 1 10 8  10 o 0 30.3269  0.506475  7.2179       -32.1236     17.9917      9.51209      122.957    -146.582     40.8556   152.038      
1 1 1 10 8  11 o 0 23.48    0.58731   -15.7024     -3.72741     -4.92808     -2.64951     71.0474    154.126      32.4872   -14.1701     
1 1 1 10 8  12 o 0 31.1794  0.228634  -3.44485     -15.3095     25.5576      -8.33719     110.924    -177.606     20.0201   -56.7568     
1 1 1 10 8  13 o 0 22.07    0.406672  3.61948      3.60405      -0.0966328   -1.64457     68.9594    0.376393     23.5599   168.744      
1 1 1 10 8  14 o 0 23.554   0.408672  -5.01447     2.50074      -0.828335    0.873752     89.118     157.074      10.3262   -8.04466     
1 1 1 10 8  15 o 0 15.117   0.570979  -3.89366     1.50098      -1.12918     1.24094      73.3834    91.5092      41.5948   130.454      
1 1 1 10 8  16 o 0 9.52508  0.159746  0.397066     0.101823     2.87581      1.21013      43.339     -172.473     19.2834   146.36       
1 1 1 10 8  17 o 0 12.726   0.139964  1.9154       0.269354     -0.674782    -0.540642    51.1345    -31.1895     7.29986   -53.5176     
1 1 1 10 9  0  o 0 20.3985  0.153267  0.151227     0            0            0            79.3677    0            12.3034   180          
1 1 1 10 9  1  o 0 28.5857  0.559203  -19.8418     2.76707      -24.1336     5.57728      90.1463    96.2525      41.3309   -89.7587     
1 1 1 10 9  2  o 0 34.937   0.7885    -13.4452     9.23796      -2.7061      6.03903      124.103    143.203      15.4943   2.03138      
1 1 1 10 9  3  o 0 19.9698  0.519544  -0.487824    -9.41411     1.45839      -0.179612    72.1956    -94.1377     12.9886   7.70245      
1 1 1 10 9  4  o 0 35.1031  0.735928  5.82817      17.1457      3.52565      -2.87169     158.51     49.7411      54.2493   66.0479      
1 1 1 10 9  5  o 0 13.5389  0.773715  88.0935      -2.52437     -48.4354     2.40691      48.316     -57.0249     15.1499   60.1245      
1 1 1 10 9  6  o 0 27.3994  0.321444  -0.138249    6.19685      8.67064      -0.650098    109.133    169.761      44.9568   -117.559     
1 1 1 10 9  7  o 0 17.4135  1.66857   -90.6537     27.4163      -20.7369     14.0612      56.4085    164.93       17.5215   -39.8563     
1 1 1 10 9  8  o 0 39.0262  0.176572  -1.89834     -2.21465     0.223792     -0.667114    130.308    -178.628     35.9196   -8.67382     
1 1 1 10 9  9  o 0 23.767   0.120495  -3.73857     -1.19899     -3.71208     -3.57228     72.5886    122.8        33.7725   -49.1072     
1 1 1 10 9  10 o 0 21.8754  1.12345   8.95889      -39.4423     6.87823      3.16927      83.3799    -74.4031     64.6717   -149.894     
1 1 1 10 9  11 o 0 29.0802  0.753126  52.8339      2.2881       -31.2437     -1.72035     107.995    71.9765      34.4419   160.132      
1 1 1 10 9  12 o 0 11.1208  0.309469  1.2914       -11.6954     7.87093      1.52827      48.9974    -167.044     42.0793   142.197      
1 1 1 10 9  13 o 0 18.0361  0.57136   9.83241      -0.598926    -4.0342      0.821196     80.5351    47.9031      19.1413   20.3356      
1 1 1 10 9  14 o 0 32.2989  0.439374  -1.72917     0.748935     -0.220128    0.464282     123.956    -157.748     11.197    34.5443      
1 1 1 10 9  15 o 0 23.5278  0.59787   6.63436      0.797316     -1.70987     -0.97185     114.306    0.475285     44.0508   -5.32541     
1 1 1 10 9  16 o 0 8.93751  0.415413  0.635139     -3.22783     0.909051     0.552806     26.0349    -116.599     22.8759   4.95605      
1 1 1 10 10 0  o 0 15.1129  0.131193  0.173234     0            0            0            55.9505    0            29.5686   1.05966e-13  
1 1 1 10 10 1  o 0 41.9413  0.55236   9.13902      -2.3672      -7.40464     3.07432      210.283    57.4408      97.1616   63.9468      
1 1 1 10 10 2  o 0 33.9193  0.866568  -0.289315    17.3611      5.74688      0.457895     125.652    84.8356      10.6672   -57.9206     
1 1 1 10 10 3  o 0 35.082   0.28743   1.27033      2.09365      0.121059     -0.259327    133.925    66.2248      1.58122   -69.9616     
1 1 1 10 10 4  o 0 12.3931  0.586201  6.00042      25.0918      10.8685      -5.72728     66.2019    117.768      52.7755   82.186       
1 1 1 10 10 5  o 0 26.5438  0.332211  -18.8309     0.18288      -10.3059     -0.254632    122.205    -120.07      60.7483   -161.776     
1 1 1 10 10 6  f 1 41.2881  0.183124  -1.9375      -14.6406     24.0378      -2.83813     145.776    -174.504     25.1565   2.11017      
1 1 1 10 10 7  o 0 8.85703  0.757769  -26.9545     13.702       -5.02747     6.80216      40.345     141.961      47.6457   90.1593      
1 1 1 10 10 8  o 0 13.6711  0.569737  -1.2022      10.0039      2.60322      0.575553     59.5444    119.808      32.8441   74.9461      
1 1 1 10 10 9  o 0 36.9172  0.914677  12.1689      28.825       5.96391      -5.5316      172.34     69.9122      69.3453   66.5187      
1 1 1 10 10 10 o 0 17.8817  1.46338   -2.02526     91.0609      22.6719      1.23069      71.9767    84.5845      13.9664   110.011      
1 1 1 10 10 11 o 0 14.1322  0.0986305 -1.01138     -0.424706    -12.0097     -4.29664     48.7461    -100.251     40.3448   170.953      
1 1 1 10 10 12 o 0 12.3949  1.16649   -2.35528     34.1729      11.8994      1.95575      63.2233    58.5223      32.737    88.7905      
1 1 1 10 10 13 o 0 17.0918  1.03567   -9.92721     18.1724      2.65574      3.77662      57.1805    132.855      26.9769   -5.48873     
1 1 1 10 10 14 o 0 17.5747  0.257874  -0.417197    -0.309422    0.0497989    -0.103913    45.9156    -134.368     46.8159   47.9052      
1 1 1 10 10 15 f 1 25.6905  0.366468  -0.353039    0.404605     0            0            86.7107    129.585      28.8682   -50.5762     
1 1 1 10 10 16 o 0 10.2908  0.265167  -0.514142    -0.133721    0            0            34.2501    139.414      8.68678   -83.9869     
1 1 1 10 11 0  o 0 34.2505  0.260776  -0.223305    2.7347e-17   0            0            133.815    0            30.2612   180          
1 1 1 10 11 1  o 0 20.7815  1.30947   61.406       16.0967      -14.7836     -8.58701     70.912     7.68791      15.6775   -156.01      
1 1 1 10 11 2  o 0 10.5683  0.0844428 1.47353      1.14034      -2.23811     -6.1517      38.0985    -80.2925     46.1405   -158.534     
1 1 1 10 11 3  o 0 41.9461  0.699045  1.84233      -13.3031     2.35932      0.537382     162.278    -55.4218     13.8076   -137.019     
1 1 1 10 11 4  o 0 51.5114  0.680529  14.968       -9.00454     -2.23855     5.692        214.666    25.381       40.6464   -8.86121     
1 1 1 10 11 5  o 0 27.0219  1.08694   43.6901      -9.08622     -13.3566     6.13975      100.835    23.2572      22.5862   118.175      
1 1 1 10 11 6  o 0 15.3097  0.678237  13.0305      30.4509      9.05737      -9.14413     39.5718    40.9707      57.2283   156.699      
1 1 1 10 11 7  o 0 46.7831  1.40937   34.9157      7.67925      -7.69011     -3.09229     191.971    39.8929      33.3853   11.3705      
1 1 1 10 11 8  o 0 43.5598  1.43446   -53.8928     -9.47174     -13.0824     -4.12998     179.328    -139.648     34.1006   -168.348     
1 1 1 10 11 9  f 1 7.88914  0.2265    3.34255      -4.54616     1.09388      3.89457      14.7587    -86.8691     8.47347   177.474      
1 1 1 10 11 10 o 0 16.7046  0.829301  12.5141      -11.4293     -0.776627    5.98734      64.9627    -0.511244    10.4902   -41.5508     
1 1 1 10 11 11 f 1 24.4651  1.48215   33.5579      0.709751     -9.64407     -0.888222    87.4494    8.54582      22.8789   -161.846     
1 1 1 10 11 12 o 0 9.23663  0.730509  9.34851      13.4089      1.60108      -4.62343     44.8289    71.5483      29.4366   30.7528      
1 1 1 10 11 13 o 0 12.3084  0.152763  0.592808     0.060471     -0.0706743   -1.02144     57.959     -53.9346     24.8114   -26.8108     
1 1 1 10 11 14 o 0 18.8084  1.05666   -8.00494     0.764457     -2.59832     -0.0828722   69.8736    149.792      10.5597   15.7085      
1 1 1 10 11 15 o 0 27.5372  0.372595  -0.0874082   0.882211     0            0            110.923    100.668      6.54871   97.6832      
1 1 1 10 12 0  o 0 7.54321  0.143086  -0.0345928   4.2364e-18   0            0            26.0515    0            19.7186   -180         
1 1 1 10 12 1  o 0 16.3314  0.731695  -17.1368     24.0268      2.95518      9.21069      45.3197    130.567      27.4555   -47.2776     
1 1 1 10 12 2  o 0 29.5918  0.497822  -14.8088     10.0329      -2.80648     8.3518       117.793    -156.54      8.04068   -173.899     
1 1 1 10 12 3  o 0 6.60438  0.946854  3.9999       55.4652      19.3265      -2.70238     36.1111    107.732      68.0402   148.699      
1 1 1 10 12 4  o 0 16.6881  0.865622  -29.0152     -12.3629     -6.60346     -6.64231     67.2706    -134.048     11.4957   -147.204     
1 1 1 10 12 5  o 0 17.2416  0.336124  9.77426      6.45499      -2.05589     -5.21084     70.4003    -22.1759     15.9648   23.9033      
1 1 1 10 12 6  o 0 9.54549  0.600065  2.60501      -27.2575     11.6139      2.07485      16.5751    -22.4559     39.6376   138.129      
1 1 1 10 12 7  o 0 22.9484  1.27526   -27.7981     60.4339      11.4715      13.0473      65.4935    123.779      40.8644   -60.0569     
1 1 1 10 12 8  o 0 16.5575  0.56922   -7.30135     3.22113      -2.53969     2.40623      86.941     -148.08      53.6787   -156.322     
1 1 1 10 12 9  o 0 42.531   0.515573  -2.44343     -9.2006      12.0845      -1.60947     188.204    -172.508     24.914    178.832      
1 1 1 10 12 10 o 0 14.7867  0.540193  -3.82651     -5.02066     0.714806     -2.1108      61.8184    -171.569     11.2853   -116.024     
1 1 1 10 12 11 o 0 8.07174  0.741972  -9.26301     -2.1856      -2.22473     -1.19427     11.8617    -171.028     37.9198   18.4202      
1 1 1 10 12 12 o 0 6.64315  0.684934  1.63099      -2.9724      0.499229     0.977318     22.2271    -74.9425     1.22582   46.2903      
1 1 1 10 12 13 o 0 29.5814  0.627261  0.871581     4.0419       3.0462       1.66248      114.024    38.5415      15.3657   -78.7126     
1 1 1 10 13 0  o 0 9.54463  0.129203  -0.00277592  3.39953e-19  0            0            34.8843    0            5.02101   5.37272e-13  
1 1 1 10 13 1  f 1 9.44554  0.801776  10.7174      22.5927      3.07237      -3.83218     25.0708    29.2805      56.594    -54.1503     
1 1 1 10 13 2  o 0 17.82    1.22986   -67.6094     -7.16712     -16.917      -3.43928     82.2466    -160.103     37.3998   164.328      
1 1 1 10 13 3  o 0 34.4009  0.951547  1.14111      24.9676      9.19925      -1.30407     141.929    96.6797      23.3022   121.367      
1 1 1 10 13 4  o 0 14.9855  1.26871   81.8123      -6.49046     -19.0812     2.88192      56.5668    -4.52665     27.8776   78.2655      
1 1 1 10 13 5  o 0 16.1073  0.401978  0.00518654   2.90485      1.18096      -0.142758    58.845     41.4926      1.27167   -168.51      
1 1 1 10 13 6  o 0 31.2982  0.447475  2.11844      2.16943      -0.300117    -1.09613     148.627    72.3287      36.9288   77.9497      
1 1 1 10 13 7  o 0 36.0098  0.24957   0.439277     -0.287771    0.586081     -1.04325     139.624    -63.3633     23.986    82.6248      
1 1 1 10 13 8  o 0 36.295   1.06087   -24.1628     -0.0980806   -11.87       -1.60151     168.778    -128.564     46.6498   -95.0842     
1 1 1 10 13 9  o 0 28.2152  0.769507  -2.24393     -10.413      2.8527       -1.72976     137.517    -80.5917     44.9513   -75.5134     
1 1 1 10 13 10 o 0 10.8204  0.300614  -1.88968     0.6838       -2.49282     0.635562     48.8908    96.6339      25.9783   152.376      
1 1 1 10 13 11 o 0 15.5309  0.49495   -0.569475    0.433261     -0.12414     0.0582381    44.2625    97.0489      34.6566   -90.1111     
1 1 1 10 13 12 f 1 14.2423  0.45359   1.80787      0.30045      -0.951694    -0.94356     59.4989    -52.015      9.15459   -22.3653     
1 1 1 10 14 0  o 0 4.58258  0.178403  -0.0432794   5.3002e-18   0            0            11.2433    180          13.1404   -2.80156e-14 
1 1 1 10 14 1  o 0 31.8331  0.255392  -1.65557     -3.42215     1.53971      -1.22593     144.008    -169.777     16.3628   -174.14      
1 1 1 10 14 2  o 0 19.8016  1.17215   18.6883      -0.427731    -4.00727     0.36411      72.7351    4.62051      20.9364   -173.541     
1 1 1 10 14 3  o 0 5.30036  0.125358  -0.165321    -1.20092     8.59299      -0.0629515   18.4938    43.2903      28.9911   102.774      
1 1 1 10 14 4  o 0 10.3653  0.133766  -1.71981     1.29705      -2.52168     4.57368      52.958     68.312       20.8079   84.3034      
1 1 1 10 14 5  o 0 15.5291  0.125818  0.734332     -2.43527     1.33929      1.30191      63.5313    -10.7448     13.1117   72.3888      
1 1 1 10 14 6  o 0 7.22004  0.131411  0.00959849   0.0287163    0.386093     -0.0795861   12.4832    -27.1777     32.4433   109.633      
1 1 1 10 14 7  o 0 6.37767  1.03422   0.403667     8.17987      2.291        -0.0888533   31.7958    87.8684      20.9369   65.0894      
1 1 1 10 14 8  o 0 21.7336  0.762436  -3.80092     -0.288787    -1.29211     0.278176     79.4104    -124.986     19.7727   74.3832      
1 1 1 10 14 9  o 0 20.1913  1.65927   -0.841795    20.3025      5.1604       1.06353      104.811    73.0539      47.4814   70.7844      
1 1 1 10 14 10 o 0 13.6369  0.235994  -1.1797      0.388013     -0.215585    1.10724      31.2999    167.405      46.8672   -36.7864     
1 1 1 10 15 0  o 0 34.7649  0.444448  0.526266     0            0            0            150.413    0            19.5639   9.43112e-14  
1 1 1 10 15 1  o 0 6.29625  0.349204  -1.66092     1.07443      -0.518516    0.791124     23.9128    145.113      12.4381   135          
1 1 1 10 15 2  f 1 17.7481  1.03471   -6.57916     2.66779      -1.16251     0.766839     75.1582    150.374      2.44206   107.128      
1 1 1 10 15 3  o 0 19.0465  1.28135   -1.16501     -6.28549     1.1144       -0.68973     70.3567    -96.0259     18.7748   75.1123      
1 1 1 10 15 4  o 0 2.50376  0.476295  1.99425      0.945386     -0.646752    -0.684364    18.0859    51.4478      31.054    69.127       
1 1 1 10 15 5  o 0 11.4426  1.27021   -9.27412     -4.81273     -1.692       -1.89293     54.224     -154.073     19.463    -134.604     
1 1 1 10 15 6  o 0 13.7252  0.132954  -0.0511393   -0.700936    0.347941     0.140974     55.1081    -158.008     4.17325   -67.626      
1 1 1 10 15 7  o 0 18.8821  0.437165  -1.23662     0.488526     -0.070628    0.678734     82.9929    -157.515     12.7123   -155.364     
1 1 1 10 16 0  o 0 19.1807  0.287615  0.485482     0            0            0            82.8958    180          11.6116   -9.3837e-14  
1 1 1 10 16 1  o 0 8.35923  0.342999  -1.5118      -0.417129    -0.971331    -0.256781    25.2897    -132.341     17.5003   -1.20376     
1 1 1 10 16 2  o 0 15.0685  0.173375  0.0727782    -0.353144    -0.0982737   -0.543127    41.8552    -118.973     42.2397   46.5497      
1 1 1 10 16 3  o 0 10.9273  0.220819  0.209376     0.68992      0.506519     0.0541106    48.9036    34.1737      12.1102   17.8191      
1 1 1 11 0  1  o 0 48.1446  0.398601  -1.0935e-17  -0.0595274   0            0            175.399    -90          33.0037   90           
1 1 1 11 0  2  o 0 16.7422  0.206491  -0.107304    1.31409e-17  0            0            61.0959    0            37.6121   180          
1 1 1 11 0  3  o 0 21.5546  0.209055  -3.84484e-19 -0.00209303  0            0            75.3121    -90          35.7143   -90          
1 1 1 11 0  4  o 0 15.03    0.174282  -0.131262    1.6075e-17   0            0            55.2209    180          106.215   -4.35035e-15 
1 1 1 11 0  5  o 0 26.3875  0.234757  -2.36226e-18 -0.0128595   0            0            97.0637    90           43.8929   -90          
1 1 1 11 0  6  o 0 15.0399  0.151394  0.0389422    0            0            0            52.0673    0            0.212091  180          
1 1 1 11 0  7  o 0 39.7668  0.283387  -2.04353e-17 -0.111245    0            0            146.109    90           49.171    90           
1 1 1 11 0  8  o 0 10.6771  0.161443  0.107224     0            0            0            18.9102    0            0.878483  4.54763e-13  
1 1 1 11 0  9  f 1 35.4246  0.243907  -1.64107e-18 -0.00893355  0            0            136.014    90           40.7411   90           
1 1 1 11 0  10 o 0 26.6195  0.208729  0.0570659    0            0            0            101.707    180          74.4247   -9.22103e-15 
1 1 1 11 0  11 o 0 14.1739  0.146635  2.66566e-18  0.00870671   0            0            48.893     -90          23.5384   -90          
1 1 1 11 0  12 o 0 25.229   0.208348  0.0161284    0            0            0            95.1286    180          14.9809   -180         
1 1 1 11 0  13 f 1 30.8561  0.241171  4.60391e-18  0.0150375    0            0            115.398    -90          7.74524   -90          
1 1 1 11 0  14 f 1 3.09839  0.293582  -0.0348414   4.26684e-18  0            0            4.29198    180          22.2509   -0           
1 1 1 11 0  15 f 1 5.47723  0.193848  6.68477e-18  0.0218341    0            0            16.8387    90           17.5543   -90          
1 1 1 11 0  16 o 0 32.0998  0.221213  -0.428574    5.24852e-17  0            0            116.494    180          6.6989    -180         
1 1 1 11 0  17 o 0 15.0366  0.157943  -7.79137e-19 -0.00424142  0            0            59.6087    90           16.6706   90           
1 1 1 11 0  18 o 0 3.89872  0.425478  0.0754657    0            0            0            14.5486    180          45.7      -8.10065e-15 
1 1 1 11 1  0  o 0 6.34823  0.183639  6.65354e-18  0.0217321    0            0            16.9022    90           48.5713   -90          
1 1 1 11 1  1  o 0 24.5453  0.387958  -16.1985     -0.32715     -16.7834     -1.38545     80.4907    98.7182      31.2774   -18.1605     
1 1 1 11 1  2  o 0 79.7924  0.395745  -0.0381458   0.105157     -0.158924    0.0741721    271.14     -133.948     37.5082   44.1084      
1 1 1 11 1  3  f 1 34.0245  0.938072  63.9583      3.2007       -30.3198     -2.53797     114.966    48.7555      61.9657   -50.9055     
1 1 1 11 1  4  o 0 43.8843  0.58476   1.91736      -1.97139     -0.0984715   0.865698     179.987    -49.8885     44.4998   -52.9629     
1 1 1 11 1  5  o 0 8.91712  0.108576  1.46884      -0.089973    -2.61965     0.392876     21.9516    -138.365     50.4667   159.037      
1 1 1 11 1  6  o 0 42.9309  0.511893  6.1492       -4.63746     -0.658957    2.04962      153.436    -32.3764     3.09539   166.865      
1 1 1 11 1  7  o 0 37.864   0.811188  -19.7313     -1.27928     -5.84616     -0.665628    133.08     150.134      14.9341   -92.4379     
1 1 1 11 1  8  o 0 40.8817  0.491908  -3.71623     3.75188      0.146408     1.3655       182.406    145.151      73.128    146.422      
1 1 1 11 1  9  o 0 11.6066  0.453008  -25.3823     -1.18165     -22.0926     -1.68029     36.5419    -68.0633     53.5713   17.5004      
1 1 1 11 1  10 o 0 20.3551  0.354536  3.73077      2.23172      -0.819779    -1.33852     35.6516    68.2468      77.1657   -116.832     
1 1 1 11 1  11 o 0 57.8112  0.450125  -1.53143     -0.817426    -0.234209    -0.209537    229.793    164.781      23.2705   170.55       
1 1 1 11 1  12 o 0 32.7126  0.390277  6.78392      -2.75036     -1.74593     2.04396      99.5901    -49.2207     44.3383   137.034      
1 1 1 11 1  13 o 0 29.2445  0.618106  -19.793      -0.00712581  -7.7321      -0.409751    122.721    131.129      29.8635   139.362      
1 1 1 11 1  14 o 0 20.7658  0.283277  -1.11968     3.93388      0.808871     0.546709     48.6275    125.313      52.6668   -48.7093     
1 1 1 11 1  15 o 0 25.6139  0.653972  -23.7602     -0.871885    -11.6331     -1.1995      98.8941    124.661      22.3395   -178.912     
1 1 1 11 1  16 o 0 12.3247  0.111196  -0.0321687   -0.0892499   -0.637834    -0.526114    46.0267    -56.0447     15.4584   -144.362     
1 1 1 11 1  17 o 0 25.5424  0.237526  1.8089       0.210462     -0.206846    -0.00867508  117.1      52.514       36.11     43.7916      
1 1 1 11 1  18 o 0 13.181   0.480823  1.16416      -0.171049    -0.460815    -0.063932    56.1267    -57.966      14.102    -49.2215     
1 1 1 11 2  0  o 0 6.39531  0.160123  3.00427e-18  0.00981268   0            0            9.75177    -90          22.7429   90           
1 1 1 11 2  1  o 0 49.4     0.237129  0.346164     -3.59019     5.21476      0.125617     138.237    -172.28      87.5445   -19.8898     
1 1 1 11 2  2  o 0 81.3174  0.737106  0.728997     8.19933      10.6234      0.730666     328.169    21.5582      79.7095   -10.6646     
1 1 1 11 2  3  o 0 44.3782  0.224495  0.114693     -0.855628    0.0730802    -0.00732434  201.436    150.574      86.275    154.834      
1 1 1 11 2  4  o 0 27.3942  0.520382  -0.299252    20.1831      18.5816      1.23462      80.7472    18.9613      38.0988   -167.913     
1 1 1 11 2  5  o 0 33.7777  0.844482  -4.82992     -22.4516     7.34962      -3.0472      111.358    -140.243     27.8631   85.9016      
1 1 1 11 2  6  o 0 35.492   0.218657  -0.289249    -1.77641     1.15113      -0.1547      89.6212    -161.506     76.5108   17.6685      
1 1 1 11 2  7  o 0 18.201   0.785983  11.1843      20.1903      3.82036      -6.26777     46.5201    83.0293      44.2692   -52.6275     
1 1 1 11 2  8  o 0 31.4502  1.55805   -10.2492     60.4424      12.1936      4.03465      95.0344    101.274      38.1434   -100.493     
1 1 1 11 2  9  o 0 37.2845  0.230851  0.799333     -0.399333    -0.177493    0.764579     123.483    33.701       33.128    -148.944     
1 1 1 11 2  10 o 0 38.2276  0.466393  -1.3161      4.22095      1.30895      0.813214     151.688    99.201       19.5593   97.8878      
1 1 1 11 2  11 o 0 37.6156  0.872595  -0.143735    -17.3048     4.16621      -0.195713    144.574    -72.0638     7.84539   -93.2387     
1 1 1 11 2  12 o 0 4.89883  0.315147  -0.355423    -3.21729     0.791547     -0.18099     3.84098    -123.842     22.7794   97.3558      
1 1 1 11 2  13 o 0 15.3436  0.101704  0.381115     0.585245     5.46965      -3.52529     68.0091    -20.7446     30.7645   -56.6615     
1 1 1 11 2  14 o 0 12.6611  0.360155  0.0959686    -16.8497     10.43        -0.131771    74.1062    -143.651     64.6967   -122.864     
1 1 1 11 2  15 o 0 10.1377  0.0947861 -1.56632     1.32641      -0.205578    2.26343      31.1891    68.4522      16.7082   -175.721     
1 1 1 11 2  16 o 0 21.1191  0.420521  -0.52828     4.56632      2.1661       0.901109     89.4659    108.1        15.8076   109.909      
1 1 1 11 2  17 o 0 36.5592  0.612526  -0.632848    -5.25707     4.93704      0.823669     157.207    -156.69      28.19     -172.796     
1 1 1 11 2  18 o 0 21.2806  1.2161    -0.751581    -4.21314     0.674885     -0.0406373   64.2942    -85.7547     35.931    104.217      
1 1 1 11 2  19 o 0 7.84308  0.965785  -0.397599    -2.57243     0.383415     -0.0924356   38.5248    -142.169     37.0179   -106.884     
1 1 1 11 3  0  o 0 37.3243  0.251486  -6.25318e-17 -0.340407    0            0            135.184    90           55.8356   90           
1 1 1 11 3  1  o 0 32.5544  0.850552  -27.6352     -2.18196     -8.45819     -1.17258     170.622    -145.934     113.09    -147.539     
1 1 1 11 3  2  o 0 48.9164  0.525765  5.73337      -1.21113     -2.57813     0.974884     197.589    -67.339      43.3328   -67.7166     
1 1 1 11 3  3  f 1 90.0256  0.515701  -11.0091     -2.69307     -6.87927     -2.00418     363.701    -104.658     72.6661   -103.991     
1 1 1 11 3  4  o 0 77.3826  0.373131  4.6247       0.344783     -2.91814     0.322625     300.989    -90.0191     46.7451   -58.0434     
1 1 1 11 3  5  o 0 68.3805  0.437491  -1.81335     -0.207126    -0.175609    -0.0231176   255.247    111.924      17.1445   148.678      
1 1 1 11 3  6  o 0 7.6329   0.766486  -38.0963     8.75796      -16.6135     8.00149      17.106     158.676      40.4663   82.4196      
1 1 1 11 3  7  o 0 45.616   0.928654  17.3952      1.67983      -3.95677     -0.581274    182.127    1.63248      36.7159   9.25786      
1 1 1 11 3  8  o 0 39.8278  0.344412  -6.41854     4.59765      -1.97611     3.98271      162.398    79.4341      48.6872   136.919      
1 1 1 11 3  9  o 0 50.6592  0.333795  2.95682      1.1813       -1.57523     -0.913009    188.43     -41.7477     6.90649   173.915      
1 1 1 11 3  10 f 1 40.1597  0.741212  -16.7209     -4.41178     -5.63884     -2.75304     136.19     -117.436     58.4619   127.235      
1 1 1 11 3  11 o 0 24.1437  0.147803  0.117232     -0.668252    0.537021     0.617312     96.3904    17.5381      15.4833   5.50968      
1 1 1 11 3  12 f 1 43.6042  0.224443  9.54676      -1.86453     -10.4374     2.00906      175.954    -82.4816     26.5398   -80.5691     
1 1 1 11 3  13 o 0 20.8801  0.461957  -7.74475     -0.00271619  -2.32111     0.0958199    66.9549    -144.477     18.6972   58.2412      
1 1 1 11 3  14 o 0 25.1892  0.175941  0.105449     -0.60995     0.770872     0.556487     75.3044    -130.503     33.7972   73.5152      
1 1 1 11 3  15 o 0 16.2302  0.385007  -8.32574     -2.61952     -2.16087     -1.4249      81.8804    167.329      52.4269   172.98       
1 1 1 11 3  16 o 0 29.4905  0.769881  -11.7547     -2.15837     -4.635       -2.25838     116.613    131.536      19.0702   -139.647     
1 1 1 11 3  17 o 0 31.6758  0.208977  0.0537442    -0.423122    0.0154129    0.00808188   138.202    113.291      28.5025   114.185      
1 1 1 11 3  18 o 0 14.6785  0.192001  1.14516      0.72138      -2.50623     -0.305548    60.8963    83.4083      15.6891   130.716      
1 1 1 11 3  19 o 0 12.5093  1.00353   -4.42175     0.441645     -0.965901    0.0421563    41.972     -156.945     13.7501   78.8158      
1 1 1 11 4  0  o 0 26.2698  0.224568  -6.4286e-18  -0.0349957   0            0            95.0761    90           31.6573   90           
1 1 1 11 4  1  o 0 26.9549  0.355633  -1.79817     -21.3869     25.4619      -3.50881     119.286    -171.461     43.7006   -170.009     
1 1 1 11 4  2  o 0 28.3871  0.696435  -1.28918     24.3716      10.6383      0.892521     105.84     47.0268      52.6902   121.831      
1 1 1 11 4  3  o 0 56.1281  0.2671    0.127094     0.0513942    -0.0720267   -0.00310127  199.926    -176.879     5.34413   6.20276      
1 1 1 11 4  4  o 0 59.4789  0.28563   -1.2465      2.84194      1.1599       0.966291     221.854    176.387      14.0608   155.695      
1 1 1 11 4  5  o 0 19.3959  0.446412  2.44966      31.4497      36.4266      -4.92266     70.3327    13.1382      11.5597   103.262      
1 1 1 11 4  6  f 1 31.2582  0.155049  0.813103     1.26089      1.3467       -1.67289     118.372    4.61696      43.2065   -59.2044     
1 1 1 11 4  7  o 0 14.1197  0.403903  7.50209      28.3641      21.5853      -11.8384     45.3798    -6.57958     20.4792   -124.862     
1 1 1 11 4  8  o 0 59.0536  0.26777   0.8529       -0.690697    0.382583     0.830915     255.166    -168.635     65.5749   -155.486     
1 1 1 11 4  9  o 0 31.9159  0.340056  4.12439      -6.70776     1.37165      3.43067      135.212    -105.991     39.4342   -134.542     
1 1 1 11 4  10 o 0 23.9135  0.347902  -3.97541     -2.28116     -0.518095    -0.970062    110.389    -151.53      46.3139   -152.121     
1 1 1 11 4  11 o 0 36.5797  0.894256  -2.66793     30.1929      13.0568      1.85602      165.569    150.64       67.4492   122.132      
1 1 1 11 4  12 o 0 59.297   0.280124  -1.97424     -2.00692     0.121053     -0.523453    228.579    -89.9162     16.1164   -102.861     
1 1 1 11 4  13 o 0 5.66587  0.662046  4.34157      21.8941      8.00047      -3.38798     28.2318    84.7479      35.8777   117.31       
1 1 1 11 4  14 o 0 22.4156  0.309591  -0.843278    0.0593726    -0.0290941   -0.00155954  93.2944    171.919      26.0189   172.497      
1 1 1 11 4  15 o 0 18.7043  0.841701  -9.41222     23.0468      3.6314       3.67363      59.7201    122.532      24.9489   3.13518      
1 1 1 11 4  16 o 0 11.4668  0.13181   0.775299     0.0989626    -0.255124    -0.134172    40.6927    56.6482      3.32708   -73.9292     
1 1 1 11 4  17 o 0 14.7407  1.05728   4.63966      -31.3266     12.2574      3.21442      75.4659    -127.67      42.192    -101.368     
1 1 1 11 4  18 o 0 12.5679  0.176778  0.155336     0.109083     0.0232905    -0.0624298   24.5373    -32.094      45.3448   143.832      
1 1 1 11 5  0  o 0 5.31977  0.199177  1.82155e-17  0.0594964    0            0            4.07829    90           9.14616   -90          
1 1 1 11 5  1  f 1 16.2324  0.26385   2.08419      -0.671434    -0.497019    0.358926     12.3096    -4.04401     85.6129   -173.395     
1 1 1 11 5  2  o 0 33.346   1.02549   24.7906      -1.98678     -6.98643     1.23835      107.096    -16.1494     22.0171   163.318      
1 1 1 11 5  3  o 0 31.1259  0.199183  2.03621      1.63321      -0.531172    -1.55396     93.197     -33.1489     37.2655   127.522      
1 1 1 11 5  4  o 0 43.9063  1.7665    -55.7627     -4.58505     -12.0579     -1.77971     182.186    -174.761     48.991    -170.143     
1 1 1 11 5  5  o 0 23.1258  0.337972  3.44467      -4.78215     0.371286     1.15929      110.611    -76.5619     66.6144   -63.1924     
1 1 1 11 5  6  o 0 10.5426  1.71504   175.9        -20.8532     -47.2884     11.2575      47.945     11.9191      50.6192   59.7887      
1 1 1 11 5  7  f 1 40.819   0.19722   0.336307     -0.416048    -0.345447    0.365117     193.884    -61.4343     84.5721   -66.4378     
1 1 1 11 5  8  o 0 21.2097  0.341686  6.94807      -4.93302     -1.64858     4.03747      82.9318    -91.4098     38.7498   -155.288     
1 1 1 11 5  9  o 0 35.648   0.322793  8.37422      -2.97678     -2.99266     2.84722      151.369    21.3481      38.4809   42.3752      
1 1 1 11 5  10 o 0 33.4736  1.11418   -44.9949     -5.37212     -12.9762     -3.55336     137.508    155.077      24.874    159.223      
1 1 1 11 5  11 o 0 39.7577  0.551056  -6.61145     8.54011      0.517191     2.99731      149.629    89.295       6.69118   148.05       
1 1 1 11 5  12 o 0 25.2417  1.43873   74.5495      3.57938      -18.3987     -1.49344     104.328    -4.4229      28.4225   24.8388      
1 1 1 11 5  13 o 0 23.2967  0.888961  -15.4133     -7.33328     -1.54145     -1.79243     87.8511    -160.307     18.4213   -95.3211     
1 1 1 11 5  14 o 0 23.3761  0.130146  0.76537      0.918893     0.224734     -0.500195    65.1211    126.576      38.559    -46.578      
1 1 1 11 5  15 o 0 15.4093  0.110832  0.782517     -0.321958    -0.912863    0.564685     59.9981    -115.894     23.6992   -34.3325     
1 1 1 11 5  16 o 0 19.0202  1.58905   -35.9235     -8.58536     -7.87331     -3.73373     78.093     -175.165     17.0743   -118.679     
1 1 1 11 5  17 o 0 19.2705  0.464582  -0.24152     0.266387     0.0503497    0.0601311    92.0705    125.153      37.4253   125.879      
1 1 1 11 5  18 o 0 7.64199  0.27152   -0.0509919   -0.339607    0            0            25.282     -107.083     1.36837   -67.0745     
1 1 1 11 6  0  o 0 19.1807  0.165402  -1.09602e-18 -0.00596646  0            0            69.6094    90           14.3974   -90          
1 1 1 11 6  1  o 0 6.11373  0.778706  -2.95813     -56.9133     35.6172      -3.82364     29.6289    86.1278      80.1978   101.964      
1 1 1 11 6  2  o 0 42.8696  0.258708  0.0707355    -0.744733    0.116402     0.00491517   150.091    -112.361     7.06982   50.768       
1 1 1 11 6  3  o 0 39.3701  0.249494  0.0894198    -2.36245     0.420728     0.0447161    135.307    86.5929      10.2254   -69.4093     
1 1 1 11 6  4  o 0 15.4165  0.526641  8.24678      16.8541      5.09952      -6.88136     20.7433    85.9657      79.493    -42.7141     
1 1 1 11 6  5  f 1 7.91048  1.6426    -9.111       -167.815     50.8886      -5.42818     44.6564    -85.8613     45.3959   -59.8425     
1 1 1 11 6  6  o 0 35.7374  0.30513   -6.37024     -1.00921     -1.27706     -0.499722    91.9814    -143.834     86.5341   51.1439      
1 1 1 11 6  7  o 0 16.1839  1.37986   4.80174      80.4329      18.0006      -2.26106     45.4017    92.7257      31.8136   -114.317     
1 1 1 11 6  8  o 0 10.5227  0.928199  -4.12356     -48.6551     12.4377      -2.19643     4.9768     84.1303      86.2854   86.4701      
1 1 1 11 6  9  o 0 12.2358  0.545491  5.3983       -15.8293     4.44552      3.30433      48.67      -94.9315     16.8141   -54.0624     
1 1 1 11 6  10 o 0 15.834   0.17577   3.71219      6.46467      5.11892      -7.99948     46.7393    144.431      26.7146   -62.9712     
1 1 1 11 6  11 f 1 23.5444  0.472337  -2.15173     24.1849      16.5812      3.55955      101.338    163.692      28.0663   156.144      
1 1 1 11 6  12 o 0 14.4728  0.371359  7.60999      -2.95991     -2.17208     1.90507      55.2307    -2.01055     13.3875   -0.343242    
1 1 1 11 6  13 o 0 24.9977  0.508003  -0.467315    -9.88772     3.1725       -0.472656    69.9495    -66.8565     41.996    104.537      
1 1 1 11 6  14 o 0 19.4842  0.885513  6.33696      -50.6257     13.8114      3.73279      69.9136    -105.31      2.21684   -28.79       
1 1 1 11 6  15 f 1 24.4307  0.478781  0.866023     -10.4812     3.07959      0.762799     101.145    -26.9309     38.9088   -97.175      
1 1 1 11 6  16 o 0 16.4096  0.351314  0.590459     2.14974      1.14443      -1.13938     61.2423    -23.0848     26.2139   70.2935      
1 1 1 11 6  17 o 0 11.6719  1.44105   -2.8972      11.489       2.97803      1.24758      35.6312    127.089      16.6655   -43.7212     
1 1 1 11 6  18 o 0 23.9682  1.281     1.8659       -2.57103     0.362312     0.386527     99.9163    -122.551     20.3681   -94.2687     
1 1 1 11 7  0  o 0 102.179  0.631733  -2.39456e-16 -1.30354     0            0            372.225    -90          44.5101   -90          
1 1 1 11 7  1  o 0 14.1189  0.458036  -13.4102     -3.39898     -5.75542     -3.31509     55.3376    -126.009     36.1239   164.062      
1 1 1 11 7  2  o 0 35.5207  1.00211   -35.0049     -7.06369     -6.70481     -2.64567     109.847    -161.071     56.8595   54.1006      
1 1 1 11 7  3  o 0 39.2817  1.30496   50.5002      -8.43323     -11.0944     4.06055      167.659    -10.1798     40.6841   0.213336     
1 1 1 11 7  4  o 0 39.9691  0.632166  -31.031      1.23397      -12.301      0.5174       166.717    129.849      56.7788   -176.296     
1 1 1 11 7  5  o 0 23.7445  0.85399   -25.0006     21.0899      -1.20411     6.62777      80.7237    138.908      14.8703   -46.2836     
1 1 1 11 7  6  o 0 18.5224  1.5124    105.163      -5.12977     -28.9838     3.02529      63.4919    0.57802      11.5542   116.775      
1 1 1 11 7  7  o 0 37.9888  0.734027  -12.2204     -4.30033     -3.32143     -2.47702     146.045    169.236      6.47252   150.717      
1 1 1 11 7  8  o 0 42.7357  0.363467  0.41372      -0.055096    -0.0263269   0.0121806    177.009    -75.3818     33.2601   -72.446      
1 1 1 11 7  9  o 0 27.7712  0.786351  45.4658      -8.01416     -24.8994     8.10163      127.766    -68.6066     53.455    -43.1902     
1 1 1 11 7  10 o 0 18.1185  0.89652   35.2883      -0.927834    -9.33346     0.359608     69.1821    -0.460953    9.39443   -25.8168     
1 1 1 11 7  11 o 0 41.4703  0.63188   -4.01739     5.20183      1.2362       2.93924      151.61     68.997       3.74457   -83.5213     
1 1 1 11 7  12 o 0 20.4728  0.748773  25.5006      6.96016      -4.94082     -3.0455      71.453     22.7433      10.61     -96.4212     
1 1 1 11 7  13 o 0 23.3603  0.816572  29.7228      9.04258      -19.3906     -11.8155     90.8726    92.4768      34.7161   158.123      
1 1 1 11 7  14 o 0 21.0277  0.242694  -1.91029     0.602367     -0.270108    0.150263     84.1477    164.949      3.60953   152.058      
1 1 1 11 7  15 o 0 11.3375  0.733008  13.1909      0.0867154    -6.1514      0.11089      30.9993    48.8544      29.3717   -100.419     
1 1 1 11 7  16 o 0 8.63205  1.45878   8.65015      1.89179      -1.47265     -0.571145    40.4682    19.3714      22.2794   -13.0641     
1 1 1 11 7  17 o 0 11.6901  0.1957    0.574795     0.723208     0.0813278    -0.155194    35.1493    124.395      18.1821   -25.0973     
1 1 1 11 8  0  o 0 1.61245  0.44693   1.1078e-18   0.00361836   0            0            0.0110616  -90          1.59856   90           
1 1 1 11 8  1  o 0 41.797   0.557097  0.17626      -12.6956     12.8719      1.75566      162.759    -158.371     46.3973   -80.8928     
1 1 1 11 8  2  o 0 58.771   0.474206  0.378707     -22.0715     11.0711      -0.442439    262.647    -150.282     77.6028   -148.05      
1 1 1 11 8  3  o 0 34.3144  0.290748  -3.86784     -3.99429     -0.0982397   -1.73113     132.955    160.396      51.8069   -124.408     
1 1 1 11 8  4  o 0 13.9685  0.282837  6.46466      26.9618      34.4293      -16.4664     77.0173    -26.6707     74.7942   -65.2826     
1 1 1 11 8  5  o 0 37.2272  1.03418   -3.33527     -23.0947     7.00125      -2.36441     163.285    -129.482     45.7519   -131.627     
1 1 1 11 8  6  o 0 20.7309  0.307363  5.24919      -4.82734     -0.290684    2.27913      97.3594    -28.5263     46.025    -29.0313     
1 1 1 11 8  7  o 0 13.2419  0.280646  -3.07246     6.10472      1.35819      1.95572      56.1657    115.221      26.4245   112.203      
1 1 1 11 8  8  f 1 8.29239  1.48806   -3.38515     116.138      40.2959      2.1869       13.9398    -49.481      89.675    -47.1747     
1 1 1 11 8  9  o 0 36.475   0.175197  -0.067435    0.124101     0.719892     -0.752663    125.764    -70.9995     23.4522   74.2038      
1 1 1 11 8  10 o 0 20.6526  0.52163   7.71233      22.9482      13.9815      -11.261      79.2132    133.619      24.8146   59.9098      
1 1 1 11 8  11 o 0 37.9355  0.479077  0.449607     -7.04232     1.78217      0.438508     143.763    -135.768     11.8366   -89.2501     
1 1 1 11 8  12 o 0 12.8436  0.63689   -17.6653     25.8979      3.67956      9.69413      38.618     88.5124      14.721    -74.4708     
1 1 1 11 8  13 o 0 7.93464  0.113619  0.438509     0.14114      -0.167261    -0.14742     24.9276    -68.0245     12.2112   -7.74093     
1 1 1 11 8  14 f 1 29.8839  2.02723   7.18102      -49.2786     13.3537      3.28792      121.399    -49.2048     27.8261   -124.43      
1 1 1 11 8  15 o 0 23.3463  0.216155  0.516682     0.0849981    0.216674     -0.223127    86.5932    -1.14872     9.24449   -169.739     
1 1 1 11 8  16 o 0 25.7902  0.495661  0.684657     -0.0438573   0.555609     -0.159969    104.344    -46.8831     11.9139   -9.95186     
1 1 1 11 9  0  o 0 15.5371  0.134     8.13402e-18  0.0265677    0            0            59.5506    90           11.7283   90           
1 1 1 11 9  1  o 0 15.2778  1.09432   -51.7987     -1.29281     -12.385      -0.485062    73.1632    -179.036     51.132    -136.865     
1 1 1 11 9  2  o 0 50.2704  0.892779  7.26707      11.0241      0.533495     -1.57195     210.913    70.2321      39.0366   60.5757      
1 1 1 11 9  3  o 0 12.6499  0.537686  42.4984      -2.6426      -41.4529     4.47559      63.0696    93.0602      62.2105   127.311      
1 1 1 11 9  4  f 1 2.98528  0.236573  2.09748      -2.43145     0.184251     1.31332      27.2967    -66.1939     44.3548   -75.3688     
1 1 1 11 9  5  o 0 28.1947  0.361704  -2.22486     0.72254      -3.84758     4.92578      72.4727    -118.476     75.4835   30.191       
1 1 1 11 9  6  o 0 20.3593  0.33123   -0.988975    -0.394067    -0.392167    -0.219952    64.2766    153.964      20.9882   -25.4694     
1 1 1 11 9  7  f 1 41.0865  1.03383   -53.2118     -5.69616     -13.364      -3.26672     185.324    155.267      68.1497   177.73       
1 1 1 11 9  8  o 0 38.897   0.238373  -0.121465    0.803794     0.48986      1.67306      160.891    -152.016     31.8225   -149.135     
1 1 1 11 9  9  o 0 17.1354  0.853033  69.6851      -6.23302     -48.3919     9.62961      53.8085    45.5702      43.3965   -62.6496     
1 1 1 11 9  10 o 0 12.7866  0.0995945 -0.883946    -1.81407     0.57807      -0.889489    34.9468    -179.131     22.2381   -18.9288     
1 1 1 11 9  11 f 1 8.74845  0.454718  3.57897      -7.3463      1.11442      1.39617      55.1208    -59.8301     55.8264   -64.5302     
1 1 1 11 9  12 o 0 17.2621  0.732817  -6.14408     2.84131      -0.685643    0.928345     77.5889    178.292      23.8533   147.326      
1 1 1 11 9  13 o 0 16.7467  0.500468  20.4096      3.905        -15.6286     -7.52291     64.3676    -60.4595     5.51748   147.609      
1 1 1 11 9  14 o 0 29.6389  0.376068  -0.429238    0.635913     0.185461     0.0635157    134.999    57.7025      36.7848   59.5342      
1 1 1 11 9  15 o 0 7.8443   0.557064  -3.48486     -0.737195    -2.79532     -0.671525    36.5602    -111.642     23.0626   -156.733     
1 1 1 11 10 0  o 0 34.3584  0.224097  -7.07673e-18 -0.0385239   0            0            132.447    -90          32.435    -90          
1 1 1 11 10 1  o 0 26.9036  0.189746  3.13723      1.52898      -0.513397    -0.594304    94.6944    7.97713      13.7482   176.831      
1 1 1 11 10 2  o 0 37.3045  1.53086   -8.07731     -67.6441     21.9307      -4.69823     125.851    -130.11      48.562    102.326      
1 1 1 11 10 3  o 0 28.4685  0.339107  -5.10107     -0.849801    -2.18862     -0.997559    111.045    169.361      14.2444   119.504      
1 1 1 11 10 4  o 0 17.873   1.52247   -10.6806     -102.623     27.2052      -5.488       42.2094    -90.8356     52.048    115.602      
1 1 1 11 10 5  o 0 63.9531  0.849015  1.50368      -2.02623     1.73253      1.16548      257.84     -94.4288     31.1102   -101.552     
1 1 1 11 10 6  o 0 5.0071   0.311493  0.333686     -3.66785     1.21239      0.203069     30.0787    -93.7057     42.9486   -116.92      
1 1 1 11 10 7  o 0 23.3011  0.168     2.47307      3.5167       2.17148      -4.31115     54.4223    -20.2304     65.7756   171.848      
1 1 1 11 10 8  o 0 50.9218  1.59642   0.167964     82.3108      21.4049      0.777972     204.146    63.1868      28.4211   78.1966      
1 1 1 11 10 9  f 1 15.6894  0.148648  4.08356      -3.12444     -1.27512     3.6444       69.3909    29.6082      32.139    62.7036      
1 1 1 11 10 10 o 0 28.1537  0.416322  1.93358      7.387        6.11279      -2.05989     116.018    6.73673      8.37729   73.6731      
1 1 1 11 10 11 f 1 24.1517  0.87981   -1.97982     16.0152      3.65333      0.770603     109.728    115.552      27.1123   105.142      
1 1 1 11 10 12 o 0 34.7132  0.925286  3.18323      -12.1002     3.21143      2.36318      153.079    -120.242     28.2666   -112.024     
1 1 1 11 10 13 o 0 19.9199  0.165991  -0.784177    -0.196749    0.385638     -0.687927    76.305     163.936      4.39775   15.3022      
1 1 1 11 10 14 o 0 23.6093  0.340263  -1.42918     -0.348894    0            0            96.2973    154.297      9.88066   -176.698     
1 1 1 11 11 0  o 0 56.1836  0.364285  1.97257e-16  0.64429      0            0            216.951    90           32.1539   90           
1 1 1 11 11 1  o 0 22.8451  0.734908  -18.4719     8.80217      -4.37527     5.10327      83.4773    152.13       4.59082   36.5905      
1 1 1 11 11 2  o 0 63.2421  0.286565  2.08078      -1.96344     0.340021     1.41512      248.629    30.2632      15.3351   0.908693     
1 1 1 11 11 3  o 0 17.0986  0.264422  -14.7461     0.955201     -26.0965     1.79434      62.7427    91.2954      13.0144   -17.884      
1 1 1 11 11 4  f 1 24.6053  0.963514  -26.3429     -15.6026     -3.7412      -6.43933     124.555    -167.644     68.7775   -153.965     
1 1 1 11 11 5  o 0 24.744   0.13831   -4.36702     0.118433     -4.57702     -0.392033    88.9285    107.532      10.044    -35.4024     
1 1 1 11 11 6  o 0 24.3629  1.20733   -47.481      4.22617      -14.0885     2.76332      106.301    -161.217     33.035    -147.615     
1 1 1 11 11 7  o 0 46.5878  0.444652  15.8777      -2.93047     -7.083       1.82919      179.908    -63.7254     10.847    -71.7753     
1 1 1 11 11 8  o 0 33.4611  0.531108  -4.59906     4.52487      0.364062     2.01996      134.267    -169.688     22.7945   165.482      
1 1 1 11 11 9  o 0 29.8535  0.417912  7.11354      -1.35459     -9.38244     1.2151       122.372    -82.516      8.53614   -165.219     
1 1 1 11 11 10 o 0 19.2967  0.393141  12.7535      4.16406      -7.70087     -4.65295     91.4544    82.9805      27.3853   77.2812      
1 1 1 11 11 11 o 0 6.46013  0.416002  -0.977703    -0.229075    -0.0540805   -0.0244916   13.2567    -96.3479     30.1838   166.852      
1 1 1 11 11 12 o 0 29.5162  0.24787   3.37691      1.39172      -2.93409     0.423766     105.181    74.062       25.0128   -98.1177     
1 1 1 11 11 13 o 0 23.8135  0.563948  -2.35285     0.655758     -2.00859     -0.629056    88.7739    131.042      17.2549   10.4555      
1 1 1 11 12 0  o 0 24.8193  0.251277  -1.44595e-17 -0.0787137   0            0            95.9669    -90          26.603    90           
1 1 1 11 12 1  o 0 51.8143  0.283331  1.15636      0.736578     6.28412      -2.8432      229.364    -26.6492     66.9322   -3.91337     
1 1 1 11 12 2  o 0 22.0763  0.329254  4.19087      8.86252      5.64202      -5.84258     88.0278    138.291      10.1599   102.956      
1 1 1 11 12 3  o 0 23.8989  0.495537  7.00802      -1.84612     -1.28856     0.672602     91.5228    -32.4106     5.28565   16.2667      
1 1 1 11 12 4  o 0 28.6621  0.732016  -2.99855     21.1116      4.73498      1.49131      99.4288    62.0539      36.8786   175.989      
1 1 1 11 12 5  o 0 17.9207  0.614177  2.66191      -53.478      31.5595      3.80657      76.0566    -160.493     31.922    146.571      
1 1 1 11 12 6  o 0 8.10148  0.121909  -1.02314     0.236205     -0.711429    0.211213     33.3583    -127.43      16.8773   -160.481     
1 1 1 11 12 7  o 0 20.5783  0.54458   -3.43911     -14.018      7.88466      -3.34462     91.3019    -164.298     25.1467   -110.507     
1 1 1 11 12 8  o 0 26.1834  0.234097  0.181513     3.84046      2.8677       -0.915435    114.37     158.541      19.5229   122.799      
1 1 1 11 12 9  o 0 16.9972  0.706587  -5.23858     8.66663      1.55173      3.59149      55.7648    77.4583      25.8966   -86.342      
1 1 1 11 12 10 o 0 12.0256  0.557604  -0.117349    -2.00828     0.833771     0.222326     48.9205    -92.2856     8.58479   -124.487     
1 1 1 11 12 11 o 0 38.3784  0.334009  3.02279      -7.70938     4.49778      0.815456     163.255    1.78949      32.8801   -50.5634     
1 1 1 11 12 12 o 0 10.4358  0.2975    0.289791     0.344069     0.325099     -0.122639    37.4934    27.1603      5.38291   -85.8977     
1 1 1 11 13 0  o 0 48.1778  0.377905  -1.65128e-16 -0.898916    0            0            206.275    -90          37.4606   -90          
1 1 1 11 13 1  o 0 26.5414  0.314544  0.350466     4.59828      1.6253       -0.535359    117.228    136.558      11.9855   116.542      
1 1 1 11 13 2  o 0 13.0721  0.572499  -8.25858     1.30834      -2.40453     0.89597      59.7625    167.776      17.8607   174.926      
1 1 1 11 13 3  o 0 22.945   0.139653  -0.0356973   -0.118731    -0.14637     0.113189     90.4266    66.3108      9.36917   -115.967     
1 1 1 11 13 4  o 0 25.5298  0.851357  13.0663      3.12197      -5.13312     -2.02164     100.718    43.5464      23.7634   155.054      
1 1 1 11 13 5  o 0 42.3733  0.2342    1.17849      0.429008     0.0800625    -1.06566     192.211    -42.724      32.3476   -34.6397     
1 1 1 11 13 6  o 0 17.8141  0.271287  6.84713      0.254323     -10.8129     1.3785       82.0885    77.9106      17.5915   89.2859      
1 1 1 11 13 7  o 0 43.9476  1.22509   0.659677     -5.03643     0.476729     0.0467749    189.384    -14.9647     20.8749   -49.6766     
1 1 1 11 13 8  o 0 14.5631  0.140314  0.12718      0.337329     -0.23894     0.531785     52.8261    87.0126      14.3952   -43.8867     
1 1 1 11 13 9  o 0 9.37187  0.238286  0.333995     -0.0266541   -0.0462874   0.00707329   29.5023    6.25997      24.7821   5.1992       
1 1 1 11 13 10 o 0 21.7048  0.225701  0.311152     -1.24431     0            0            92.0161    -73.9641     11.7645   -75.1914     
1 1 1 11 14 0  o 0 10.5783  0.149136  2.63068e-17  0.0859244    0            0            30.2308    90           21.1752   90           
1 1 1 11 14 1  o 0 15.5916  0.944913  0.0992498    20.262       7.36748      -0.383977    75.7475    55.9962      24.9678   38.0336      
1 1 1 11 14 2  o 0 33.903   0.292068  -1.82974     2.8687       0.318541     1.26548      155.058    97.3343      24.6913   90.7209      
1 1 1 11 14 3  o 0 18.6541  0.156655  0.14839      0.102042     0.0389032    -0.0687382   86.2328    -1.05139     19.0784   -1.42248     
1 1 1 11 14 4  f 1 17.0429  0.553122  -0.41842     -1.45274     0.1476       -0.306926    95.3246    -81.9526     53.6108   -82.1223     
1 1 1 11 14 5  o 0 10.9093  0.248927  0.437781     -2.29232     3.77074      -0.495546    55.8898    -12.071      23.2847   -5.61294     
1 1 1 11 14 6  o 0 24.6807  0.18818   -0.353694    -0.624662    -0.0775373   0.83317      101.078    -118.769     4.28909   151.067      
1 1 1 11 14 7  f 1 7.71577  1.20889   0.652652     11.2633      3.11486      -0.179871    13.3708    74.2448      32.2921   -106.624     
1 1 1 11 14 8  o 0 12.2512  0.375225  -0.986445    1.40911      0.498642     0.537689     24.183     164.762      48.6945   -22.9559     
1 1 1 11 15 0  o 0 2.19089  0.492391  9.57192e-18  0.0312642    0            0            0.500865   90           0.845259  -90          
1 1 1 11 15 1  o 0 23.2428  0.68729   -2.14847     -2.66114     -0.353651    -1.18168     102.313    -78.8098     10.4896   -107.218     
1 1 1 11 15 2  o 0 6.9989   0.182825  0.319869     0.372743     -0.401402    -0.530316    17.405     -50.0601     25.6605   72.9584      
1 1 1 11 15 3  o 0 4.45898  0.338987  2.24334      0.0519221    -1.43348     -0.274859    1.12096    -150.336     29.6577   -140.176     
1 1 1 11 15 4  o 0 17.9132  0.588117  -1.77791     0.263945     -0.460085    0.382571     60.7897    -153.287     25.4575   24.751       
1 1 1 11 15 5  o 0 5.31304  0.199659  -0.0973719   0.0177629    0.317531     0.0580812    8.61649    -177.667     18.2539   31.2794      
1 1 1 12 0  0  f 1 78.529   0.95422   -0.376478    4.61053e-17  0            0            280.484    0            8.49557   0            
1 1 1 12 0  1  o 0 34.5253  0.35264   -9.73325e-18 -0.0529854   0            0            123.645    -90          8.17156   -90          
1 1 1 12 0  2  o 0 36.4266  0.29005   -0.121727    1.49073e-17  0            0            130.761    0            28.7437   180          
1 1 1 12 0  3  o 0 28.1354  0.243133  -1.69202e-17 -0.0921091   0            0            101.181    90           6.08348   90           
1 1 1 12 0  4  f 1 41.5139  0.320303  0.222113     0            0            0            149.465    0            44.8154   180          
1 1 1 12 0  5  o 0 11.9373  0.144831  1.69711e-17  0.0554319    0            0            23.9009    90           2.334     90           
1 1 1 12 0  6  o 0 11.9624  0.136368  0.123387     0            0            0            42.3097    180          51.6353   -0           
1 1 1 12 0  7  f 1 19.3184  0.164243  1.26872e-17  0.0414397    0            0            72.8074    90           9.29304   -90          
1 1 1 12 0  8  o 0 43.3693  0.282912  0.113495     0            0            0            163.346    0            34.2518   180          
1 1 1 12 0  9  o 0 2.77489  0.306565  -3.51058e-19 -0.00191107  0            0            2.61126    -90          18.7096   90           
1 1 1 12 0  10 f 1 36.7655  0.267324  -0.287289    3.51827e-17  0            0            137.215    0            21.0964   0            
1 1 1 12 0  11 o 0 39.165   0.259982  5.58826e-17  0.182526     0            0            145.265    90           82.3366   90           
1 1 1 12 0  12 o 0 4.17133  0.237773  -0.0399318   4.89023e-18  0            0            1.10034    0            5.01169   180          
1 1 1 12 0  13 o 0 12.5897  0.164636  -7.36187e-18 -0.0400762   0            0            45.8932    -90          16.4394   90           
1 1 1 12 0  14 o 0 31.6433  0.269475  -0.0607484   7.43953e-18  0            0            114.498    0            8.96264   180          
1 1 1 12 0  15 o 0 1.92354  0.41842   -5.81656e-19 -0.00316639  0            0            0.00523838 90           0.33661   -90          
1 1 1 12 0  16 o 0 33.9102  0.263354  0.398035     0            0            0            132.916    180          12.9379   -180         
1 1 1 12 0  17 o 0 29.5939  0.388527  1.08894e-16  0.355674     0            0            114.644    -90          6.71207   -90          
1 1 1 12 1  0  o 0 79.2969  0.554765  -0.402212    4.92567e-17  0            0            283.167    -180         32.9531   180          
1 1 1 12 1  1  o 0 18.8101  1.44363   94.337       -7.25903     -32.2905     5.18693      94.4234    -34.2357     67.3824   -7.66467     
1 1 1 12 1  2  o 0 2.71799  0.599679  6.76471      -4.55393     -0.840995    2.05854      34.3516    -153.834     79.5173   -163.021     
1 1 1 12 1  3  o 0 35.7808  0.29979   1.4148       0.649387     -0.424454    -0.591573    124.371    57.0191      4.58216   171.324      
1 1 1 12 1  4  o 0 16.6415  0.330846  5.02636      0.60303      -2.30342     -0.629291    69.649     47.228       38.4088   41.9772      
1 1 1 12 1  5  o 0 50.4995  1.30392   54.0459      2.19524      -21.2238     -2.66064     179.988    -47.7739     48.6039   -135.158     
1 1 1 12 1  6  f 1 42.6665  0.369465  -0.714894    2.1035       0.205954     0.135959     112.736    161.452      79.2567   -3.73739     
1 1 1 12 1  7  o 0 34.8444  0.834845  -27.5197     -3.27666     -9.84755     -2.03352     141.855    -129.916     48.2658   173.743      
1 1 1 12 1  8  o 0 14.5613  0.78318   18.4659      -17.2848     -0.33578     6.36954      62.3678    -44.9309     44.8852   -96.2434     
1 1 1 12 1  9  o 0 59.1824  0.532523  -7.79433     -2.23947     -1.15927     -0.915804    234.783    -149.6       28.0993   -156.523     
1 1 1 12 1  10 o 0 9.64459  0.316712  3.43299      -1.34339     -1.39692     1.3635       16.9576    -75.8143     32.4401   106.44       
1 1 1 12 1  11 o 0 19.8931  1.2366    -59.4147     -7.12383     -13.8455     -3.53168     89.5695    -179.26      37.4042   -164.101     
1 1 1 12 1  12 o 0 6.44669  0.134696  -0.389361    0.213444     -0.0559335   0.103655     5.89615    135.357      24.2784   157.932      
1 1 1 12 1  13 o 0 26.3081  0.978379  -31.1816     2.33232      -6.69985     0.839385     78.8708    -175.062     36.4615   38.6591      
1 1 1 12 1  14 o 0 25.5093  0.132227  -2.7455      -0.561909    -2.89083     -0.681123    80.6413    -95.2437     21.5976   96.7968      
1 1 1 12 1  15 o 0 23.4748  0.352378  -4.55044     -1.12998     -0.829897    -0.354205    90.1003    -179.889     4.22361   -57.6972     
1 1 1 12 1  16 o 0 20.9304  0.152144  -2.61367     -0.457623    -0.669393    -0.149027    93.1057    -109.076     28.825    -130.692     
1 1 1 12 1  17 o 0 22.8669  2.05893   15.669       0.0426577    -3.20434     -0.55888     98.955     -18.2501     23.4938   -12.3089     
1 1 1 12 2  0  o 0 9.23038  0.14924   0.0757478    0            0            0            8.9382     0            0.85464   180          
1 1 1 12 2  1  o 0 38.4094  0.19223   -1.09695     -0.988976    1.02282      -4.78805     125.372    144.7        33.3272   -88.9803     
1 1 1 12 2  2  o 0 24.4424  0.327086  -1.5173      -8.64739     5.26797      -2.08242     97.371     -34.4072     23.4674   -23.7423     
1 1 1 12 2  3  o 0 25.7869  1.31337   12.0489      51.8935      11.2158      -5.63087     88.2465    77.7698      6.80123   -163.64      
1 1 1 12 2  4  o 0 48.8643  1.30475   12.6424      -33.7212     7.58403      7.03549      197.077    -77.0179     49.4631   -85.7368     
1 1 1 12 2  5  o 0 52.4348  0.254719  1.02599      -2.58399     0.836781     1.40563      204.927    -39.1177     38.506    -30.6362     
1 1 1 12 2  6  o 0 7.66768  0.137207  -0.458326    3.9802       15.7949      2.65808      16.9918    177.896      7.79899   7.57361      
1 1 1 12 2  7  o 0 26.6808  0.450679  3.36929      8.75332      2.49807      -2.07471     106.544    54.3081      25.4106   36.4445      
1 1 1 12 2  8  o 0 44.7831  0.533166  0.758298     0.974023     -0.00540473  -0.175109    167.377    83.9775      4.80918   37.969       
1 1 1 12 2  9  o 0 38.3114  1.0118    -1.69524     -17.3614     6.09224      -1.62402     158.58     -103.791     34.4318   -105.026     
1 1 1 12 2  10 o 0 35.9314  0.467377  -1.57642     12.7892      4.97339      1.61375      112.396    71.5194      44.0581   -81.3379     
1 1 1 12 2  11 o 0 29.02    0.661764  -4.41243     -5.74676     0.29221      -1.46703     91.5948    -129.652     28.3995   45.5765      
1 1 1 12 2  12 o 0 33.9725  0.428916  -3.59882     14.9847      6.03016      3.57565      125.37     162.627      12.1278   89.0705      
1 1 1 12 2  13 o 0 30.0861  0.284573  -0.581885    5.94825      5.14031      0.341758     130.476    22.0424      45.2554   11.9366      
1 1 1 12 2  14 o 0 35.4337  0.203979  0.184215     -0.0134808   -0.0812981   -0.367362    146.432    83.6497      39.5427   86.6494      
1 1 1 12 2  15 f 1 25.9302  1.05639   -1.36819     22.4705      4.41721      0.33581      109.629    78.052       23.1971   119.005      
1 1 1 12 2  16 o 0 27.1207  0.812159  2.01971      -7.06661     2.74468      2.35448      128.037    -89.1214     50.2604   -101.395     
1 1 1 12 2  17 o 0 16.2201  0.4686    0.492313     -0.587424    -0.0560245   0.109606     52.8579    -37.6428     16.4998   148.841      
1 1 1 12 2  18 o 0 19.3737  1.43244   -1.30453     -7.4651      1.81086      -0.249454    66.3691    -146.873     25.3458   -30.3617     
1 1 1 12 3  0  o 0 51.5946  0.329321  0.122125     0            0            0            184.354    180          41.2272   -180         
1 1 1 12 3  1  o 0 45.2229  1.13877   -32.3969     8.2733       -11.0414     6.48036      187.301    -146.449     53.9099   -150.272     
1 1 1 12 3  2  o 0 52.9295  1.58138   46.656       -7.74483     -11.6033     4.27849      196.752    -8.67352     19.1859   5.43719      
1 1 1 12 3  3  o 0 54.8329  0.264225  0.867311     1.43615      0.220864     -1.59208     207.571    148.773      35.2563   106.755      
1 1 1 12 3  4  o 0 11.745   0.969432  -67.3436     -1.37523     -24.872      -1.16942     17.8858    -144.962     84.8901   -69.9569     
1 1 1 12 3  5  o 0 14.5462  0.59483   -38.7906     -7.76476     -20.8938     -8.99335     28.9377    -119.148     16.0096   -37.7222     
1 1 1 12 3  6  f 1 23.6778  0.147332  0.0522989    -0.0947559   -0.586614    0.326888     104.464    44.8352      47.2023   61.9005      
1 1 1 12 3  7  o 0 77.2155  0.87641   -7.07583     -2.52001     -0.576238    -0.673079    286.028    -151.552     8.726     71.6715      
1 1 1 12 3  8  o 0 37.7625  0.951676  47.5425      -4.0808      -15.9569     2.30677      194.39     -44.9007     116.59    -26.3271     
1 1 1 12 3  9  o 0 31.3326  0.394566  5.57945      3.60391      -0.685111    -2.07144     150.039    -27.1813     72.4199   -13.4194     
1 1 1 12 3  10 o 0 68.6473  0.835978  -7.46382     0.347952     -2.6319      0.918776     278.023    -174.524     47.6375   -168.258     
1 1 1 12 3  11 o 0 8.21623  0.373981  8.77451      3.8811       -2.8324      -3.21937     21.5426    -160.218     92.8481   -143.907     
1 1 1 12 3  12 o 0 35.727   0.529871  -6.59146     -4.12338     -0.551545    -1.32421     88.8297    -140.068     82.2827   43.2204      
1 1 1 12 3  13 o 0 9.80645  0.163945  2.11621      -1.21776     -0.516782    0.784059     36.89      -79.1996     17.4563   -24.2259     
1 1 1 12 3  14 o 0 15.0643  1.44146   91.2751      14.6719      -21.7029     -6.98256     51.2083    11.2018      3.73945   160.215      
1 1 1 12 3  15 o 0 8.27839  0.396355  -2.08563     -0.955955    -0.316743    -0.388693    16.8507    -155.333     24.6571   28.1461      
1 1 1 12 3  16 f 1 17.435   0.693691  12.2857      1.19827      -3.3295      -0.47445     60.864     19.6165      11.4782   -170.562     
1 1 1 12 3  17 o 0 11.3269  0.383118  -1.3165      -0.0398234   -0.808279    -0.491007    31.2376    128.602      21.8074   -40.0383     
1 1 1 12 3  18 f 1 10.4499  0.315681  0.0453336    -0.262614    0            0            34.1896    -47.8896     5.8315    150.229      
1 1 1 12 4  0  o 0 12.9576  0.167602  -0.0840502   1.02932e-17  0            0            3.95825    180          3.90422   -180         
1 1 1 12 4  1  o 0 46.551   0.891851  8.30866      29.213       7.85828      -4.36224     150.35     101.891      29.1242   -69.8911     
1 1 1 12 4  2  o 0 41.9217  0.209268  -2.36198     -2.41695     0.100435     -1.26495     120.166    -131.154     55.4493   49.5473      
1 1 1 12 4  3  o 0 34.2259  1.65643   -0.0641138   -108.768     36.2829      -0.600489    106.844    -45.8378     37.1623   95.7624      
1 1 1 12 4  4  f 1 6.15959  0.579244  -17.8864     20.2031      1.35866      11.8122      17.9935    -16.0005     67.3621   -19.4157     
1 1 1 12 4  5  o 0 19.5035  0.498872  -0.962681    -15.4951     5.36174      -0.772858    63.3781    -60.7451     31.9327   -173.872     
1 1 1 12 4  6  o 0 16.1782  0.4123    2.71323      -9.26518     2.797        1.71999      64.7598    -96.6269     25.2744   -65.4797     
1 1 1 12 4  7  o 0 41.6564  1.31149   3.41759      -51.4484     12.0397      1.88008      121.66     -99.7867     69.5511   60.18        
1 1 1 12 4  8  o 0 41.5532  0.501352  -2.01995     3.26133      0.443618     0.658805     161.621    108.6        14.967    116.399      
1 1 1 12 4  9  o 0 20.0786  0.953324  -2.39662     -55.8515     26.033       -1.78489     82.6705    -139.238     37.1973   -81.296      
1 1 1 12 4  10 o 0 31.3857  0.165719  -0.134113    0.150448     0.614606     0.36734      125.729    163.684      23.9047   -177.524     
1 1 1 12 4  11 o 0 6.65327  0.121459  0.913702     1.01245      0.0877882    -1.58271     14.4528    62.9984      16.816    52.1834      
1 1 1 12 4  12 o 0 6.73114  0.127553  1.2331       0.374171     -0.408695    -0.328828    5.79906    -69.115      49.2387   -108.611     
1 1 1 12 4  13 f 1 20.0452  1.01565   -13.0534     41.0149      10.7954      8.00723      65.9675    140.09       11.9739   -21.2526     
1 1 1 12 4  14 f 1 2.70766  0.54246   -1.28375     0.985532     -0.0392357   0.138066     9.64002    32.1781      30.1546   6.54463      
1 1 1 12 4  15 o 0 20.8884  1.3804    -4.40807     38.2401      8.80443      2.35524      78.6594    104.537      13.4456   -0.813751    
1 1 1 12 4  16 o 0 18.3472  0.166574  -0.0238893   0.353875     -0.0759473   0.112012     68.4284    37.7498      4.36299   167.725      
1 1 1 12 4  17 o 0 13.5365  0.423542  0.281704     -0.00689452  -0.0183812   -0.0128463   47.6377    -9.19986     4.53812   170.008      
1 1 1 12 5  0  o 0 49.7474  0.361206  0.0878298    0            0            0            178.197    0            38.5877   9.65765e-14  
1 1 1 12 5  1  o 0 17.1496  0.62267   -8.06814     11.8461      0.856275     2.31291      48.5883    113.237      54.1516   7.08757      
1 1 1 12 5  2  o 0 29.1731  1.73188   143.745      -10.6442     -42.3578     5.88047      114.974    -32.142      18.7146   15.8343      
1 1 1 12 5  3  o 0 32.0618  0.650354  -6.03445     -9.84024     1.14886      -2.45684     146.011    -100.065     59.1038   -110.752     
1 1 1 12 5  4  o 0 27.6098  1.83595   -123.164     4.4725       -29.9477     2.46668      95.1128    179.256      46.9863   77.8837      
1 1 1 12 5  5  f 1 46.391   0.224418  -0.106118    -0.364238    0.363752     -0.391565    190.011    -38.7544     35.9581   -36.1994     
1 1 1 12 5  6  o 0 34.0675  0.325028  4.82581      1.14035      -2.40723     -0.966474    129.5      73.6322      11.0221   28.8306      
1 1 1 12 5  7  f 1 18.1108  0.277761  -4.74479     1.97185      -1.68644     1.50738      74.8412    103.627      20.4176   127.759      
1 1 1 12 5  8  o 0 23.6348  1.34653   -81.1167     -11.9785     -29.4628     -9.39464     70.797     144.114      35.9731   -56.357      
1 1 1 12 5  9  o 0 13.3128  0.203153  1.8883       1.63464      -0.15621     -0.768332    41.9621    67.7015      7.55749   -95.8949     
1 1 1 12 5  10 o 0 6.45774  0.22505   -8.90575     2.09225      -9.51733     4.49922      22.782     176.672      64.2984   -136.53      
1 1 1 12 5  11 o 0 29.3624  0.260276  -2.6639      0.159251     -2.18259     0.632169     100.989    111.479      16.8856   -16.344      
1 1 1 12 5  12 f 1 47.7478  1.13405   -17.6928     -15.1972     -1.09279     -5.04836     159.7      -157.462     28.4813   9.16991      
1 1 1 12 5  13 o 0 26.9098  0.422392  -5.86604     -1.68069     -2.24996     -1.156       107.112    -114.852     22.1671   -113.189     
1 1 1 12 5  14 o 0 21.644   1.58629   -42.0358     -8.13756     -11.3176     -4.11826     82.5799    -150.696     7.52844   -38.1485     
1 1 1 12 5  15 o 0 12.2726  0.265738  -1.38683     -0.311908    -0.108309    -0.0617501   29.1561    -68.83       38.8335   147.424      
1 1 1 12 5  16 o 0 31.4653  0.621069  4.26917      -0.63728     -0.797486    -0.0818248   129.315    15.4289      16.7617   1.68676      
1 1 1 12 5  17 o 0 2.12132  0.589593  0.00922871   0.0314357    0            0            5.05159    -12.8812     12.1231   -14.6331     
1 1 1 12 6  0  o 0 11.975   0.136229  -0.0386404   4.73208e-18  0            0            35.5691    0            7.88899   180          
1 1 1 12 6  1  o 0 15.1318  0.247121  -0.741988    -15.5298     20.6006      -1.35353     91.8058    -50.3946     121.498   -87.2108     
1 1 1 12 6  2  f 1 44.1366  0.651578  -5.11032     5.24392      0.123605     1.65308      220.697    119.656      116.333   121.567      
1 1 1 12 6  3  o 0 36.1751  0.366193  0.978993     -29.4069     39.5903      5.19026      135.805    -165.92      1.69943   85.295       
1 1 1 12 6  4  o 0 37.8611  0.286023  -2.63273     -1.3752      -1.19196     -1.17381     126.073    -72.7644     54.5973   170.649      
1 1 1 12 6  5  o 0 20.568   0.374913  3.74541      6.13046      1.94395      -4.3564      78.4613    -8.25041     21.3398   65.2053      
1 1 1 12 6  6  o 0 19.7306  0.528837  2.48177      17.9214      6.69159      -1.71472     62.1024    115.79       26.9026   -117.254     
1 1 1 12 6  7  o 0 18.8573  0.811172  -8.91318     41.9792      16.7182      7.77533      91.8353    47.4402      44.3765   39.8355      
1 1 1 12 6  8  o 0 22.5852  0.563175  0.681149     11.5226      3.37763      -0.275862    79.8223    53.0993      8.95671   175.89       
1 1 1 12 6  9  o 0 8.80346  0.0912222 0.0545401    -2.11836     21.6532      -2.66015     31.6882    -22.4335     20.061    -106.69      
1 1 1 12 6  10 o 0 10.4711  0.710137  4.27557      -21.4232     5.29418      2.27298      29.0937    -81.08       13.4778   111.006      
1 1 1 12 6  11 f 1 23.6763  0.305034  4.18183      0.130786     -0.870398    -0.0473392   96.7701    -18.4137     23.7885   -12.5205     
1 1 1 12 6  12 o 0 19.2763  0.556544  -0.835279    24.4487      14.7227      0.56333      63.6217    22.7877      17.6457   -106.866     
1 1 1 12 6  13 o 0 40.0218  1.48891   -11.4729     22.2374      4.97879      5.72862      152.641    128.44       15.0622   -89.1152     
1 1 1 12 6  14 o 0 7.56989  0.119152  -0.0543003   -0.0976956   0.0456466    -0.0505381   17.8848    157.437      11.6654   -40.1188     
1 1 1 12 6  15 o 0 14.1729  1.36024   -1.63858     7.63508      1.75955      0.532531     51.6041    100.58       5.78732   -130.755     
1 1 1 12 6  16 f 1 9.07872  0.359379  -0.191861    2.53555      1.04512      0.386779     4.074      111.244      57.7879   -67.2046     
1 1 1 12 7  0  o 0 22.1968  0.180977  -0.09901     1.21252e-17  0            0            83.9317    0            47.8613   180          
1 1 1 12 7  1  o 0 8.13631  1.07549   59.181       8.38577      -14.1774     -4.05142     15.432     99.8014      68.366    158.023      
1 1 1 12 7  2  o 0 60.2837  0.76789   -25.2859     1.80533      -16.7726     0.742613     218.39     112.906      24.5905   -20.7131     
1 1 1 12 7  3  o 0 6.93058  0.45523   -1.9014      -6.73007     0.976979     -0.589806    34.2383    -120.31      36.5485   -159.947     
1 1 1 12 7  4  o 0 5.94101  0.882648  39.0141      -5.45271     -13.9455     4.05315      21.5242    6.62565      34.6518   64.6334      
1 1 1 12 7  5  o 0 34.0568  0.629037  -14.3739     1.31424      -11.6739     3.23002      128.487    99.9044      15.1473   21.0726      
1 1 1 12 7  6  o 0 27.3905  0.418736  -5.66274     -2.23044     -2.18951     -1.81971     126.344    -135.581     55.2474   -125.462     
1 1 1 12 7  7  o 0 45.6959  1.15116   40.8363      -4.24931     -9.90539     1.67435      164.576    -10.2117     10.6045   -171.197     
1 1 1 12 7  8  o 0 15.0803  1.1222    58.1553      14.5991      -15.8577     -8.70233     61.4922    3.66582      21.2394   -6.85478     
1 1 1 12 7  9  o 0 25.4811  0.139497  -1.28286     -0.719236    -0.449737    -1.48732     79.345     143.669      27.0851   -26.1445     
1 1 1 12 7  10 o 0 15.8864  0.207436  -4.55135     2.57974      -1.65153     3.20028      67.1568    84.1804      23.4035   59.0715      
1 1 1 12 7  11 o 0 27.7445  0.482543  -29.7381     -3.32076     -22.9051     -6.31838     66.4158    122.034      72.9925   -80.8876     
1 1 1 12 7  12 o 0 23.0633  0.237359  -5.47157     -4.11696     -0.470054    -3.19771     117.281    153.795      55.7229   170.568      
1 1 1 12 7  13 o 0 30.5137  0.952332  -20.5257     1.56341      -3.62021     0.332709     149.087    -173.774     59.3612   177.915      
1 1 1 12 7  14 o 0 11.4597  0.130582  -2.02998     -0.00244531  -4.04293     -0.896003    43.5454    -96.0671     15.5374   174.364      
1 1 1 12 7  15 o 0 31.6888  1.22979   -2.84479     -1.93939     -0.800189    -0.641717    133.576    -101.026     22.2844   -107.52      
1 1 1 12 7  16 f 1 17.3568  0.93601   0.933698     0.0321309    -0.129096    0.0352117    59.6123    -22.8872     11.4793   146.763      
1 1 1 12 8  0  o 0 35.6595  0.256149  0.45741      0            0            0            135.143    180          8.43257   -180         
1 1 1 12 8  1  o 0 16.6261  0.452611  -1.66384     13.0647      4.89471      1.38868      52.8258    64.6432      22.3104   -55.0842     
1 1 1 12 8  2  o 0 33.6022  0.955131  -5.52707     25.3621      5.07534      2.51499      117.404    80.4713      24.8271   -149.582     
1 1 1 12 8  3  o 0 19.6406  1.00686   -4.04112     46.1397      12.3781      2.36615      86.8263    74.7         41.4688   116.393      
1 1 1 12 8  4  o 0 26.4635  0.34861   -0.233239    5.95339      8.61376      -0.407443    100.225    8.44933      7.08704   -56.0671     
1 1 1 12 8  5  o 0 29.9143  0.497138  -3.92085     -1.7543      -0.985068    -0.849195    114.741    -112.968     9.24616   -137.659     
1 1 1 12 8  6  o 0 20.1221  1.82424   10.1088      122.929      35.0061      -6.10345     99.4548    108.237      54.4781   88.9185      
1 1 1 12 8  7  o 0 29.263   0.903596  -6.75018     19.1299      3.96927      2.99716      112.989    85.1827      17.8045   135.007      
1 1 1 12 8  8  o 0 33.2309  0.732058  7.35563      14.8046      2.50757      -3.68752     130.507    93.8784      18.2005   77.3586      
1 1 1 12 8  9  o 0 22.7371  0.632557  4.30045      11.4246      1.65637      -1.54841     97.0092    50.4605      31.6984   69.6628      
1 1 1 12 8  10 o 0 23.1331  0.754229  -8.74533     46.6844      22.7163      9.46094      99.5355    34.0221      46.9289   -10.2837     
1 1 1 12 8  11 o 0 41.1126  0.587077  1.93427      -1.51244     -0.0637172   0.336985     140.873    27.8314      48.4426   -141.507     
1 1 1 12 8  12 o 0 34.5704  1.4394    -2.73253     44.0502      11.906       2.21415      160.121    57.6211      51.2083   82.0741      
1 1 1 12 8  13 o 0 24.0085  0.165218  -1.53113     2.68015      0.38471      1.0792       106.079    70.8074      24.7475   73.6611      
1 1 1 12 8  14 o 0 7.11621  0.651464  -1.12591     0.379086     -0.115249    0.116803     17.0293    171.597      15.5806   6.80057      
1 1 1 12 8  15 o 0 20.4961  0.589505  0.148218     -0.462768    0.116327     -0.0298409   81.2942    -89.5049     6.82358   -79.782      
1 1 1 12 9  0  o 0 24.4193  0.180888  0.077361     0            0            0            92.6946    180          53.0107   -180         
1 1 1 12 9  1  o 0 12.7836  1.06043   69.0826      -4.95938     -28.8041     3.89886      71.31      31.069       61.0022   -0.345707    
1 1 1 12 9  2  o 0 17.4756  0.464159  7.8912       0.0463668    -1.96452     -0.0817978   71.7294    -17.1428     18.6397   -1.36374     
1 1 1 12 9  3  o 0 8.17911  0.109152  0.342114     -0.111665    -0.0959343   0.0803721    17.4198    17.1237      10.5324   -137.963     
1 1 1 12 9  4  o 0 34.3395  0.230072  1.41657      -2.02171     0.0669717    0.231559     119.956    -20.3378     17.1597   -174.621     
1 1 1 12 9  5  o 0 39.4882  0.58117   7.78527      0.696026     -27.6908     4.00643      179.549    83.9523      68.5439   103.591      
1 1 1 12 9  6  o 0 5.26818  0.117159  0.714311     0.489378     -0.229175    -0.553773    10.9785    33.9353      10.0801   49.8176      
1 1 1 12 9  7  o 0 23.7595  1.70177   95.0388      -9.55698     -24.6449     5.32969      84.181     7.44344      50.5227   -81.8042     
1 1 1 12 9  8  o 0 24.0976  0.13417   -0.250667    0.219477     0.057859     0.101497     83.4491    31.2667      8.62402   -163.356     
1 1 1 12 9  9  o 0 26.9056  0.551932  14.0667      11.0233      -1.3247      -6.82348     103.176    -0.255677    18.5472   -51.8367     
1 1 1 12 9  10 o 0 17.2954  0.56929   -2.79314     -2.62187     -0.0836831   -0.631827    68.786     -131.834     2.58261   -146.098     
1 1 1 12 9  11 f 1 25.0729  2.39118   86.6576      10.6857      -18.8434     -5.23214     119.282    -1.97805     41.919    14.5612      
1 1 1 12 9  12 o 0 7.89816  0.30819   -0.135554    -1.11427     0.203498     -0.0699523   34.9729    -108.235     24.5366   -103.707     
1 1 1 12 9  13 o 0 6.29247  0.474104  -2.72552     0.575718     -1.22405     0.792303     17.0577    -145.479     9.34451   27.0693      
1 1 1 12 9  14 o 0 13.281   0.533276  0.476522     0.458698     -0.0622075   -0.10618     63.0254    72.5901      29.1349   70.9139      
1 1 1 12 10 0  o 0 24.773   0.176353  -0.380338    4.6578e-17   0            0            94.2957    0            10.5533   1.88745e-13  
1 1 1 12 10 1  o 0 14.4337  0.209875  0.363367     1.23309      0.389837     -0.204355    43.3891    42.7689      15.4881   -137.144     
1 1 1 12 10 2  o 0 16.106   0.619066  1.01045      -21.8829     8.779        1.00009      73.0095    -135.988     33.5386   -161.937     
1 1 1 12 10 3  o 0 44.7929  0.796672  0.215715     -10.0321     1.45192      -0.028776    183.411    -98.711      31.6309   -90.009      
1 1 1 12 10 4  o 0 17.7424  0.88332   6.56587      -39.2291     13.4238      4.3698       81.0196    -47.1998     43.9511   -27.1266     
1 1 1 12 10 5  o 0 19.0427  0.411953  1.20292      -3.93474     0.911357     0.559408     61.9656    -118.261     18.7244   25.1557      
1 1 1 12 10 6  o 0 34.2337  1.94487   -14.2479     -104.056     28.8638      -8.69836     124.99     -66.9727     29.1774   -162.347     
1 1 1 12 10 7  o 0 8.3736   0.0947159 -0.0765604   -0.664181    2.10555      -0.174955    34.7519    -19.0948     28.815    -72.6723     
1 1 1 12 10 8  o 0 19.9921  0.491326  6.12672      5.23876      -0.174506    -2.46468     86.4813    18.3955      14.7876   5.03439      
1 1 1 12 10 9  o 0 9.36737  0.881074  -2.22261     15.4369      3.99208      1.0725       43.3163    101.482      17.8509   102.004      
1 1 1 12 10 10 o 0 45.8499  0.927214  1.10411      -14.8526     7.4199       2.66592      203.495    -140.051     39.7394   -148.91      
1 1 1 12 10 11 o 0 3.00224  0.202453  0.1412       -0.378366    0.106236     0.103627     4.59012    -29.0683     10.5654   10.7545      
1 1 1 12 10 12 o 0 3.57538  0.900078  0.106148     -6.98066     1.95402      0.164492     20.3544    -78.2204     23.1229   -50.5059     
1 1 1 12 10 13 o 0 16.7929  0.292603  0.463429     0.138403     0            0            49.7045    27.677       29.3783   -150.562     
1 1 1 12 11 0  o 0 35.8929  0.276469  0.0641552    0            0            0            136.883    180          8.22228   -180         
1 1 1 12 11 1  o 0 28.4719  0.621438  -20.3812     3.43577      -14.2061     4.00896      130.699    102.52       47.8306   89.3307      
1 1 1 12 11 2  o 0 40.6348  0.203073  -7.30015     -0.408467    -6.04233     0.298513     157.965    94.9269      28.1564   162.721      
1 1 1 12 11 3  o 0 25.4396  0.170515  -0.534462    -0.313753    -0.0354312   -0.0529055   118.848    -98.1994     50.0413   -100.37      
1 1 1 12 11 4  o 0 20.021   0.844173  -35.2132     1.78711      -10.6015     1.28727      76.6633    -150.288     13.9375   142.903      
1 1 1 12 11 5  o 0 36.6485  1.56635   -59.53       7.07988      -13.9531     3.76899      134.31     171.381      5.54288   -56.8802     
1 1 1 12 11 6  o 0 18.1727  0.431201  1.72361      0.37294      -0.244224    -0.0814794   78.1053    12.9702      11.7139   14.6911      
1 1 1 12 11 7  o 0 45.4349  0.381014  8.46064      -3.0386      -4.61466     2.24309      182.405    -90.9255     23.0551   12.4022      
1 1 1 12 11 8  o 0 21.096   1.20918   32.7902      3.43383      -9.66182     -1.65915     94.1032    -18.9888     20.5772   -9.97142     
1 1 1 12 11 9  o 0 8.90109  0.622677  6.05698      7.20962      0.340521     -2.40154     36.8392    67.4185      16.9344   5.24027      
1 1 1 12 11 10 o 0 22.7425  0.524711  4.30626      0.671785     -1.37386     0.0177102    90.7423    70.099       14.6107   -12.4039     
1 1 1 12 11 11 o 0 12.6944  0.882819  -7.40695     0.099598     -3.47255     -0.521064    60.1861    125.96       26.5671   156.587      
1 1 1 12 11 12 o 0 25.7992  0.263154  -0.285934    -0.687377    -0.557692    -0.309144    105.933    -94.9268     11.1819   -81.4122     
1 1 1 12 12 0  o 0 16.4256  0.153799  0.131552     0            0            0            69.4114    0            1.00979   180          
1 1 1 12 12 1  o 0 17.9044  0.544826  -1.01565     8.73751      3.00869      0.487767     65.4331    51.5771      19.8765   -164.484     
1 1 1 12 12 2  o 0 36.2822  0.614808  -0.0586372   4.26486      0.805775     0.167866     155.719    91.4608      9.79019   82.8998      
1 1 1 12 12 3  o 0 29.1073  0.166147  -0.895491    -3.80786     10.8088      0.345007     146.604    -4.98923     54.6211   11.5981      
1 1 1 12 12 4  o 0 25.7701  0.385922  0.104772     -3.42625     0.728032     0.142257     117.555    -72.3097     24.9452   -77.6156     
1 1 1 12 12 5  o 0 25.4712  0.371964  -2.97882     -5.69953     1.40051      -1.56483     121.104    -147.144     35.6894   -151.821     
1 1 1 12 12 6  f 1 9.38369  0.579654  -4.22197     -11.6076     3.5663       -2.79526     33.8743    -144.511     7.33807   -19.3392     
1 1 1 12 12 7  o 0 14.8661  0.183904  0.758032     -3.57617     7.36794      1.60074      58.6816    -168.896     9.74298   87.4366      
1 1 1 12 12 8  o 0 8.10831  0.257727  -0.755963    -0.37142     -0.127503    -0.445201    14.1992    153.944      38.3291   -72.2668     
1 1 1 12 12 9  o 0 13.9024  0.89872   0.278679     -11.4876     5.1358       -0.543713    47.4955    -36.3466     15.3218   129.437      
1 1 1 12 12 10 o 0 5.71646  0.426929  -0.154897    1.5735       0.623648     0.223105     20.058     64.9262      33.7188   128.466      
1 1 1 12 13 0  o 0 3.01662  0.244552  -0.0192136   2.35299e-18  0            0            4.47765    180          10.6524   -1.20199e-13 
1 1 1 12 13 1  o 0 16.6555  0.112151  0.14984      -0.0368017   -0.0540461   -0.00479364  77.4234    58.357       19.305    57.207       
1 1 1 12 13 2  f 1 23.2901  0.790521  19.6035      -0.1191      -9.51577     0.815378     93.623     57.1678      24.173    -45.3826     
1 1 1 12 13 3  f 1 14.2646  0.101785  0.201579     0.13554      -0.0040488   -0.138285    80.1947    1.14557      50.6809   0.540574     
1 1 1 12 13 4  o 0 16.1742  0.400164  4.20686      0.120077     -3.03806     1.10511      72.4733    55.2924      23.0698   105.19       
1 1 1 12 13 5  o 0 27.2792  1.25023   0.0450903    1.50451      0.061859     0.0162044    109.588    -175.174     7.93087   68.407       
1 1 1 12 13 6  o 0 12.4771  0.120276  0.0261962    -0.113005    -0.147803    -0.145777    47.0154    125.428      3.4716    -33.0847     
1 1 1 12 13 7  o 0 8.65544  0.150863  -0.176074    0.277724     -0.0225346   0.199109     36.081     65.3627      11.7403   74.3124      
1 1 1 12 13 8  o 0 16.1734  1.52642   17.7956      0.033799     -5.56786     -0.666873    60.549     -32.5679     9.32854   -168.7       
1 1 1 12 14 0  o 0 8.6487   0.24174   0.103991     0            0            0            31.091     -180         10.4582   180          
1 1 1 12 14 1  f 1 6.09013  0.420765  0.256402     -1.85102     0.808121     0.0856938    14.1755    -56.3828     13.9518   110.093      
1 1 1 12 14 2  o 0 11.9898  0.173786  0.341183     0.189989     -0.0146569   -0.078205    48.4775    125.818      4.72575   67.6714      
1 1 1 12 14 3  f 1 10.9804  0.170756  0.636376     2.29256      3.79657      -0.197787    33.3512    -14.9959     55.3315   -108.649     
1 1 1 12 14 4  o 0 8.47835  0.126644  -0.286588    0.194462     0.349696     0.414346     30.4526    38.5239      2.71024   -125.083     
1 1 1 12 14 5  o 0 7.08994  0.361109  -0.78347     -1.90074     0.539984     -0.847678    12.8426    -149.103     25.4389   30.9453      
1 1 1 13 0  1  o 0 40.8069  0.399194  7.69134e-17  0.251218     0            0            150.853    90           13.4803   90           
1 1 1 13 0  2  o 0 27.179   0.330767  0.380084     0            0            0            100.605    0            16.9863   -4.00147e-14 
1 1 1 13 0  3  o 0 5.99166  0.217289  1.10291e-17  0.0360238    0            0            5.93205    -90          18.0365   90           
1 1 1 13 0  4  o 0 5.63028  0.180605  0.0355358    0            0            0            6.2648     180          22.166    -0           
1 1 1 13 0  5  o 0 4.07431  0.220866  2.70495e-18  0.00883505   0            0            1.68097    90           10.0334   -90          
1 1 1 13 0  6  o 0 49.0867  0.33989   -0.125276    1.53419e-17  0            0            181.544    180          9.78474   -6.84869e-14 
1 1 1 13 0  7  o 0 11       0.152419  7.99297e-18  0.026107     0            0            40.5792    -90          57.0425   90           
1 1 1 13 0  8  o 0 23.0825  0.174139  -0.245716    3.00915e-17  0            0            84.8798    180          6.92174   -180         
1 1 1 13 0  9  o 0 5.65685  0.179809  -5.36149e-18 -0.0291866   0            0            12.1633    90           16.0305   -90          
1 1 1 13 0  10 o 0 34.1672  0.252753  -0.305783    3.74476e-17  0            0            124.411    0            6.91363   180          
1 1 1 13 0  11 o 0 37.7267  0.250147  -2.11397e-17 -0.115079    0            0            136.487    -90          3.073     -90          
1 1 1 13 0  12 o 0 42.4994  0.310666  0.265001     0            0            0            152.612    0            37.6386   2.14077e-14  
1 1 1 13 0  13 f 1 4.5607   0.239268  4.94318e-18  0.0161457    0            0            12.2011    -90          21.1524   90           
1 1 1 13 0  14 o 0 31.1913  0.263858  0.442653     0            0            0            121.73     180          14.699    -180         
1 1 1 13 0  15 o 0 5.89915  0.236153  4.15669e-18  0.0135768    0            0            18.6497    90           4.51265   -90          
1 1 1 13 0  16 o 0 23.2702  0.336731  0.310482     0            0            0            88.9042    180          12.4296   -0           
1 1 1 13 1  0  o 0 5.42218  0.238274  -2.6649e-18  -0.0145071   0            0            5.73885    -90          18.1441   90           
1 1 1 13 1  1  o 0 22.6656  1.14397   48.3458      11.1925      -11.7905     -5.90442     95.1296    15.4317      32.9158   -1.11652     
1 1 1 13 1  2  o 0 23.0656  1.01118   -12.0964     -34.4856     6.78471      -5.54895     84.1735    -103.177     30.3744   177.711      
1 1 1 13 1  3  o 0 36.6003  1.95559   96.9365      5.33117      -27.3113     -3.53863     138.646    -22.6443     12.1609   17.2445      
1 1 1 13 1  4  o 0 17.5714  0.128354  1.49008      -3.43346     10.5658      8.3147       37.5509    -0.181502    60.6712   -144.048     
1 1 1 13 1  5  f 1 33.5566  0.658972  6.15941      -3.55299     -1.12971     1.63999      116.186    10.6796      21.6381   -106.688     
1 1 1 13 1  6  o 0 12.0251  0.656786  21.048       -4.56651     -5.12496     2.39255      83.2256    -10.9197     91.0868   -0.453113    
1 1 1 13 1  7  o 0 20.1057  0.612957  25.2723      5.49305      -18.1999     -7.51444     67.336     85.5393      16.9295   -137.652     
1 1 1 13 1  8  o 0 21.0483  0.638975  2.32409      6.65557      1.01697      -0.869428    92.3457    34.2861      43.1027   65.968       
1 1 1 13 1  9  f 1 15.8589  1.19017   54.6145      3.69934      -16.4465     -2.08915     64.6207    28.9621      18.2161   14.6562      
1 1 1 13 1  10 o 0 20.3417  0.456945  -5.45429     3.74823      -0.673662    1.89098      87.2469    -166.858     37.033    163.199      
1 1 1 13 1  11 f 1 24.2138  0.135203  -0.888875    0.628183     -0.186948    0.408508     62.4103    41.9703      49.986    -162.339     
1 1 1 13 1  12 f 1 12.4184  0.600466  -13.4279     4.5944       -2.5502      2.03974      34.3926    169.326      20.3165   28.845       
1 1 1 13 1  13 o 0 17.5644  0.670093  -25.2478     -8.33254     -8.48378     -6.06026     32.4973    -126.234     65.4702   90.4627      
1 1 1 13 1  14 o 0 12.4165  0.298969  -0.985825    -2.71252     0.526698     -0.518858    53.7368    -63.4945     23.3341   -103.281     
1 1 1 13 1  15 o 0 6.50283  0.9151    -21.493      -0.995258    -7.61953     -0.564705    9.78512    -143.881     25.2186   2.74699      
1 1 1 13 1  16 f 1 57.5558  3.00068   -1.67322     3.97318      0.00755956   0.303991     219.878    82.0923      3.52256   156.72       
1 1 1 13 2  0  o 0 33.3766  0.232077  -3.65299e-17 -0.19886     0            0            123.381    -90          21.9647   90           
1 1 1 13 2  1  o 0 42.1528  1.4681    -27.544      47.0331      6.18861      10.3948      174.553    119.454      43.1248   132.146      
1 1 1 13 2  2  o 0 21.0656  0.126605  1.4142       -10.9509     34.0549      12.0787      109.075    -161.709     64.2212   -150.943     
1 1 1 13 2  3  o 0 29.682   0.975784  35.5048      7.79003      -8.33034     -4.02937     125.696    11.6358      39.6798   5.29081      
1 1 1 13 2  4  o 0 27.7897  0.976527  -6.73665     -40.1504     11.0345      -3.62767     137.828    -74.9947     90.7842   -104.654     
1 1 1 13 2  5  o 0 9.98116  0.845111  -15.055      -38.4711     9.7274       -9.07474     16.9272    -123.887     41.8262   116.992      
1 1 1 13 2  6  o 0 34.4248  0.208319  -1.23736     1.99238      0.808145     2.73406      142.831    -153.005     34.2808   -159.474     
1 1 1 13 2  7  o 0 29.8924  0.779988  -0.74828     16.9372      3.98067      0.519868     90.5436    125.522      47.9828   -10.1127     
1 1 1 13 2  8  o 0 4.21442  1.00079   -12.53       32.2738      8.39996      7.75174      29.2938    96.4794      37.2314   81.2499      
1 1 1 13 2  9  f 1 22.6728  0.169604  -1.66257     -1.06209     -0.269801    -0.82098     70.6638    132.477      30.4836   -98.9974     
1 1 1 13 2  10 o 0 42.7894  0.515843  -0.416714    -6.09121     2.93479      -0.910039    198.458    -58.8389     89.7111   -52.5303     
1 1 1 13 2  11 f 1 20.3284  0.286799  -2.06041     -18.0028     12.7329      -2.33445     91.8024    -35.1922     54.4281   -74.641      
1 1 1 13 2  12 o 0 10.1197  0.29965   -6.75936     5.98252      -0.498608    5.4432       47.0882    77.2873      28.8431   73.3532      
1 1 1 13 2  13 o 0 10.5875  0.164181  0.275031     -1.56651     1.87731      1.05383      36.5797    3.5324       21.4169   78.2138      
1 1 1 13 2  14 o 0 17.2304  0.905752  3.26298      -16.413      4.74997      2.2042       62.1343    -65.2128     4.80256   115.789      
1 1 1 13 2  15 o 0 20.8386  0.260909  0.544906     0.672552     0.502117     -0.687919    83.2907    56.0626      9.42204   41.6971      
1 1 1 13 2  16 o 0 8.72033  0.675811  -0.993343    -2.52847     0.647098     -0.463033    21.9103    -77.1307     21.3904   141.424      
1 1 1 13 2  17 o 0 19.9324  0.453627  0.535464     0.0667286    0            0            66.2802    -65.4808     15.4809   101.839      
1 1 1 13 3  0  o 0 26.0058  0.223029  6.12381e-17  0.200019     0            0            96.2434    90           25.5123   -90          
1 1 1 13 3  1  f 1 38.5375  0.867742  -21.8917     -19.6021     -0.786519    -9.60776     120.39     -177.135     49.791    -33.305      
1 1 1 13 3  2  o 0 21.7568  0.828865  -26.7554     -23.2581     -1.57227     -12.7535     71.2054    -104.047     24.5139   -10.3497     
1 1 1 13 3  3  o 0 34.7691  0.805709  -34.9918     -6.50236     -13.1383     -5.53339     123.895    142.357      17.0345   -102.739     
1 1 1 13 3  4  o 0 28.9253  1.17936   -43.2141     24.5034      -6.56831     11.3748      87.9906    162.313      32.6687   -14.719      
1 1 1 13 3  5  o 0 36.0961  0.476498  -0.847903    9.4052       3.73087      1.00464      169.412    157.494      76.0029   148.227      
1 1 1 13 3  6  o 0 58.7712  0.336091  9.63074      -1.42856     -12.3178     -0.244469    217.303    -86.2525     48.4425   -1.28884     
1 1 1 13 3  7  o 0 10.5303  1.00189   -31.8532     -23.275      -3.72586     -11.364      39.5717    -131.966     17.5475   167.942      
1 1 1 13 3  8  o 0 56.8244  0.287317  1.70908      0.601245     -0.285184    -0.265459    235.912    50.5522      56.7343   49.5247      
1 1 1 13 3  9  o 0 43.3414  0.428555  -5.4127      -1.13224     -2.06557     -0.617763    162.401    -112.135     11.5675   -138.788     
1 1 1 13 3  10 o 0 22.672   0.612604  22.0529      2.75418      -9.56831     -2.11572     81.6696    59.1462      11.7249   -26.9608     
1 1 1 13 3  11 o 0 12.3353  0.254625  0.405181     2.69478      0.963305     -0.303142    41.1673    80.5938      5.15876   82.0742      
1 1 1 13 3  12 o 0 15.3378  1.25683   64.5931      5.04234      -16.9402     -2.51632     63.7056    16.5198      23.2411   -6.93146     
1 1 1 13 3  13 f 1 21.0334  0.622558  -5.63501     -6.23864     0.492677     -2.58742     77.6757    -163.18      6.94342   35.0184      
1 1 1 13 3  14 o 0 12.6443  0.219761  -1.12593     0.0630851    -0.391193    -0.0469457   35.9636    138.081      21.2848   -44.0234     
1 1 1 13 3  15 o 0 11.5953  0.280706  -0.98288     0.266455     -0.587775    0.015305     35.9864    -109.361     14.6963   96.9307      
1 1 1 13 3  16 o 0 4.96251  0.804519  -5.9276      -0.585572    -1.93753     -0.241013    6.22363    -173.893     21.0298   37.6818      
1 1 1 13 4  0  o 0 14.6424  0.162103  4.04967e-17  0.132272     0            0            6.50161    90           6.87806   90           
1 1 1 13 4  1  o 0 53.4421  0.827708  4.85752      -22.614      15.559       5.19421      206.669    -11.4701     20.1529   -30.6723     
1 1 1 13 4  2  o 0 10.8103  0.854584  20.9797      -30.3355     3.57215      9.33593      41.5037    -18.9151     75.0126   37.6029      
1 1 1 13 4  3  o 0 43.8175  0.364039  4.64481      4.16143      -0.592949    -2.43771     180.246    94.546       40.9255   85.4219      
1 1 1 13 4  4  o 0 54.5659  0.444366  4.58474      3.29444      -0.274361    -1.43063     194.974    -27.0286     18.3833   104.897      
1 1 1 13 4  5  f 1 33.5524  1.60688   2.23024      74.8746      21.7743      -1.69967     107.15     118.737      35.636    -34.2776     
1 1 1 13 4  6  o 0 23.0481  0.240589  5.39574      -3.92001     -2.31061     5.88289      103.3      39.272       40.7769   22.9177      
1 1 1 13 4  7  f 1 35.3604  0.441064  0.341251     -12.3701     11.9417      1.88277      146.792    -159.734     54.263    154.579      
1 1 1 13 4  8  o 0 29.3221  0.733026  -12.9905     8.10985      -1.36151     3.14946      97.939     154.917      15.8796   -25.6393     
1 1 1 13 4  9  o 0 15.7074  0.100514  1.33494      -2.00274     1.39273      2.73467      61.8214    19.1043      12.2951   14.4416      
1 1 1 13 4  10 o 0 23.5373  0.126051  0.987304     -0.312958    -0.574211    0.739694     100.249    -138.36      40.4289   -112.519     
1 1 1 13 4  11 o 0 34.5596  0.489722  -2.4544      17.9984      18.2515      7.49043      123.612    23.0535      23.9338   -66.7585     
1 1 1 13 4  12 o 0 37.5555  0.205916  -5.04634     1.47655      -2.10639     0.905875     135.639    94.1496      12.9803   163.7        
1 1 1 13 4  13 o 0 31.5627  0.488754  1.04023      7.99244      3.08898      -0.412499    140.267    21.2611      38.4863   43.7715      
1 1 1 13 4  14 o 0 17.5024  0.162764  -0.103078    0.0634372    -0.00484271  0.0490596    75.3365    -36.9911     20.8162   -36.9002     
1 1 1 13 4  15 f 1 32.2534  0.249025  -0.881015    -0.0871106   0.533427     0.583467     111.179    40.9626      24.3089   -135.408     
1 1 1 13 4  16 o 0 18.3988  0.449417  1.44421      0.324899     -0.222326    -0.183203    53.5996    -2.91859     30.2102   176.902      
1 1 1 13 5  0  o 0 15.5435  0.1592    -3.05536e-17 -0.166326    0            0            57.7115    -90          58.2889   90           
1 1 1 13 5  1  o 0 22.1027  0.404473  -2.39287     -13.2061     9.57066      -3.97242     93.2258    -21.9471     66.2129   36.5442      
1 1 1 13 5  2  o 0 21.8444  0.569605  23.0161      6.3281       -8.65748     -5.43328     75.6358    -40.0481     38.7264   -134.784     
1 1 1 13 5  3  o 0 17.8973  0.196764  0.355055     -0.808609    0.161282     0.113588     58.9201    -50.1036     8.68486   130.476      
1 1 1 13 5  4  f 1 22.2223  1.22531   49.0193      4.54833      -14.5568     -2.48039     76.9607    30.2264      47.0649   -62.2705     
1 1 1 13 5  5  o 0 27.8171  0.251327  -3.71213     -6.29216     4.14175      -5.76415     123.342    167.13       57.7988   -155.701     
1 1 1 13 5  6  f 1 8.46819  1.77041   126.848      4.92703      -35.166      -2.61388     14.0302    119.886      79.6357   155.154      
1 1 1 13 5  7  o 0 39.7359  0.383678  -0.231209    -4.46078     2.53102      0.0995855    130.906    -48.4562     29.9297   109.247      
1 1 1 13 5  8  o 0 31.3082  0.170251  0.0889492    0.154875     0.48523      1.23749      154.17     49.0025      84.2244   44.2266      
1 1 1 13 5  9  o 0 7.92839  0.109711  -2.50893     -0.613779    -2.1685      -1.02803     12.2081    147.491      35.1107   -81.2601     
1 1 1 13 5  10 o 0 53.0653  0.719695  15.423       4.92962      -8.45405     -7.89991     224.013    -43.4559     65.8421   -53.1783     
1 1 1 13 5  11 o 0 37.814   0.622057  -5.46453     -7.15171     0.322147     -1.36942     145.833    -142.31      21.9894   -131.431     
1 1 1 13 5  12 o 0 37.2413  0.377508  11.1896      0.653416     -7.77654     -2.41331     172.853    -56.8764     55.3258   -71.0724     
1 1 1 13 5  13 o 0 10.645   0.393999  1.93397      -1.43715     -0.192269    0.850883     41.9272    12.5992      15.1867   -46.5626     
1 1 1 13 5  14 o 0 10.8789  0.501085  -1.42124     3.84307      0.846628     0.641019     49.465     60.7459      29.1916   103.004      
1 1 1 13 5  15 o 0 21.3147  0.267285  -1.43575     -0.380138    -0.185447    -0.381472    76.3385    -168.812     8.6738    28.8809      
1 1 1 13 5  16 o 0 5.11859  0.321105  -0.0686912   0.260017     0            0            6.11539    150.447      16.9242   20.454       
1 1 1 13 6  0  o 0 64.2939  0.398801  -1.03118e-16 -0.56135     0            0            239.21     -90          21.0557   90           
1 1 1 13 6  1  o 0 39.1623  0.56137   -2.77545     -19.3598     18.6424      -3.59876     162.293    -171.561     44.3802   152.33       
1 1 1 13 6  2  o 0 40.2442  0.4079    -4.10119     -5.63628     0.69811      -3.95039     159.369    -84.0613     29.4512   -45.8528     
1 1 1 13 6  3  o 0 18.8393  0.289151  1.63834      -2.82952     0.953981     1.40389      76.0997    -54.9628     23.6625   -46.5958     
1 1 1 13 6  4  o 0 27.9915  0.511745  -8.32637     12.3353      1.73304      4.70777      132.247    71.5649      71.291    99.8728      
1 1 1 13 6  5  o 0 21.6101  1.59483   10.3485      -88.8114     25.5542      5.74823      95.4839    -108.021     36.7732   -87.902      
1 1 1 13 6  6  o 0 24.3341  0.183059  2.08514      -0.454906    -2.86786     2.01043      84.4563    61.4412      16.5893   176.538      
1 1 1 13 6  7  o 0 62.1755  0.474592  0.482736     -3.16424     4.62206      -1.15977     219.618    -23.1124     18.9223   124.237      
1 1 1 13 6  8  o 0 31.2807  0.806265  -4.34464     -20.7645     5.71633      -2.25508     108.153    -131.56      9.68579   41.3912      
1 1 1 13 6  9  o 0 21.6538  0.635077  18.1314      -14.1604     -3.00557     10.5268      77.1149    -91.1256     26.5817   -1.73551     
1 1 1 13 6  10 o 0 6.89043  0.651923  7.86918      -25.0306     8.43874      6.0116       16.1674    -72.5704     36.7939   15.8813      
1 1 1 13 6  11 o 0 30.2298  0.704679  -6.86319     18.5672      8.23727      5.72856      101.891    169.287      27.1922   56.5043      
1 1 1 13 6  12 f 1 31.1363  0.17006   0.166433     -0.636783    0.576825     -0.585521    144.374    172.877      46.5566   171.657      
1 1 1 13 6  13 o 0 17.499   0.35053   1.45136      2.75561      1.17511      -2.77938     72.3429    -20.754      13.5252   17.5282      
1 1 1 13 6  14 o 0 13.474   0.305536  -0.305426    2.8326       1.34262      0.832632     38.5651    60.9242      27.7816   -81.5811     
1 1 1 13 6  15 o 0 24.2673  0.327279  0.634836     0.225173     0            0            99.6844    -4.37215     16.3466   0.00333439   
1 1 1 13 7  0  o 0 82.2162  0.485472  2.74553e-16  0.896757     0            0            306.584    90           17.9113   -90          
1 1 1 13 7  1  o 0 19.3733  0.798503  -16.1773     25.271       3.36528      7.04234      103.546    110.123      70.9142   117.913      
1 1 1 13 7  2  o 0 22.7985  0.488818  -8.14658     4.78689      -1.92307     3.19555      96.6696    102.848      27.8636   102.271      
1 1 1 13 7  3  o 0 7.2799   1.43245   -70.146      -1.5427      -17.0017     -0.688327    17.1837    -158.191     23.8665   -34.1062     
1 1 1 13 7  4  o 0 26.0034  0.135783  -1.44899     -1.42411     -6.13121     -11.2442     67.1294    -48.2052     77.9214   78.7085      
1 1 1 13 7  5  o 0 27.544   0.813628  -17.747      -11.5374     -3.01828     -6.18275     104.385    -118.441     13.7544   -71.5884     
1 1 1 13 7  6  o 0 34.9417  0.991241  43.6151      -3.69947     -11.4927     1.60635      132.127    -31.6099     14.9911   18.8766      
1 1 1 13 7  7  o 0 10.1005  0.115491  0.955841     -0.00316762  -8.86584     3.82714      35.4253    87.9787      15.3386   -179.805     
1 1 1 13 7  8  o 0 49.841   0.296232  -0.343935    -6.00008     3.58717      0.421694     174.718    -76.5016     13.0851   93.5794      
1 1 1 13 7  9  o 0 17.1016  0.981356  60.1813      7.63156      -21.8045     -5.35507     86.8098    50.5218      51.8337   39.9336      
1 1 1 13 7  10 f 1 3.13125  1.3568    -0.012464    0.0710073    0            0            28.5104    -170.089     71.7064   -169.353     
1 1 1 13 7  11 o 0 23.0486  0.136968  -0.402397    0.0518547    -0.392895    -0.177935    99.3588    -118.97      20.5693   -111.088     
1 1 1 13 7  12 o 0 14.6441  0.726387  9.53502      -0.366164    -3.03484     0.387822     55.0884    -20.541      1.65656   15.58        
1 1 1 13 7  13 o 0 19.6437  0.17528   2.81766      0.0367436    -1.9017      -1.08609     71.3679    -47.8724     13.5887   -170.693     
1 1 1 13 7  14 o 0 9.90295  0.772618  0.104531     -2.8035      0.854754     -0.0886603   44.4307    -50.5883     19.7405   -65.327      
1 1 1 13 7  15 o 0 35.4316  0.623941  0.226053     -1.72568     0            0            144.844    -136.258     21.6992   -124.556     
1 1 1 13 8  0  o 0 13.8022  0.132754  1.10847e-17  0.0362055    0            0            50.7073    -90          10.2081   -90          
1 1 1 13 8  1  o 0 30.1612  0.571164  7.67046      12.452       2.93158      -5.14031     126.497    5.82857      32.5106   24.3239      
1 1 1 13 8  2  o 0 29.4853  0.779161  5.95994      32.5701      17.9318      -7.65871     79.1514    146.805      62.6616   -52.3315     
1 1 1 13 8  3  o 0 26.8062  0.638112  15.6128      -5.21375     -3.40821     2.4222       117.328    -33.2538     40.4051   -31.1927     
1 1 1 13 8  4  f 1 18.1614  0.673531  -4.41082     34.2719      19.6585      4.74876      69.3896    170.201      26.7888   -116.333     
1 1 1 13 8  5  f 1 15.5479  0.987619  -9.80806     33.3702      7.51403      4.69423      87.3927    119.416      70.2319   101.796      
1 1 1 13 8  6  o 0 5.50875  0.281026  1.90217      1.70526      -0.0401596   -0.427022    37.3654    43.7495      61.9717   41.0186      
1 1 1 13 8  7  o 0 17.9019  0.271339  3.47122      2.17395      -1.44047     -2.6615      62.6794    -40.5005     16.9827   56.8606      
1 1 1 13 8  8  o 0 35.3495  0.581608  -2.72193     31.3934      23.6013      5.55879      136.364    25.4549      16.1526   17.9597      
1 1 1 13 8  9  o 0 21.5119  0.280089  -4.74318     2.73433      -3.08587     3.53833      98.104     -138.575     34.468    -103.066     
1 1 1 13 8  10 o 0 37.7002  0.630847  1.55778      13.8308      6.42757      -0.374374    174.057    134.268      51.1239   143.179      
1 1 1 13 8  11 o 0 17.4219  0.131878  0.105574     0.0642151    0.611456     0.633229     62.8823    139.22       11.2197   -101.049     
1 1 1 13 8  12 f 1 44.6869  0.938371  -2.77157     1.79185      0.631651     0.897459     201.556    -152.581     55.1432   -159.905     
1 1 1 13 8  13 o 0 15.5949  1.31171   -5.46836     -1.74482     -0.787037    -0.385851    76.1841    -151.792     36.021    -154.651     
1 1 1 13 8  14 o 0 25.9975  1.38181   -3.55812     8.31296      3.34271      1.79319      90.7829    171.372      25.3613   43.5918      
1 1 1 13 9  0  f 1 15.1327  0.134271  -1.19097e-17 -0.0648332   0            0            0.140498   90           0.892612  -90          
1 1 1 13 9  1  o 0 22.6602  0.120921  3.1692       -0.603885    -6.84937     4.2251       72.1127    69.2528      23.9344   -122.93      
1 1 1 13 9  2  o 0 8.14786  0.319452  0.857224     7.74767      3.75232      -0.903803    35.5797    56.0508      38.9807   107.304      
1 1 1 13 9  3  o 0 43.6723  0.357474  15.2631      1.57542      -22.0541     -0.870774    176.786    81.3901      31.264    64.6296      
1 1 1 13 9  4  o 0 28.6768  0.549726  2.62105      7.59352      3.24392      -3.07817     116.944    120.113      28.3491   150.431      
1 1 1 13 9  5  o 0 42.8722  0.524757  -20.0345     5.82089      -4.08938     2.26022      178.959    140.889      43.5759   146.321      
1 1 1 13 9  6  o 0 43.7146  0.218585  0.823304     1.06181      0.207249     -0.279408    209.274    -97.8598     100.034   -96.1796     
1 1 1 13 9  7  o 0 15.2742  0.953604  23.6297      4.06437      -7.59575     -3.02208     63.0731    -28.4225     19.2712   -1.77829     
1 1 1 13 9  8  o 0 29.6696  0.820124  -1.21449     -8.45232     2.626        -1.12337     111.731    -155.205     19.3159   -25.0114     
1 1 1 13 9  9  o 0 36.1434  1.41476   40.6998      -3.20525     -12.4081     1.17073      141.362    -41.9698     8.00717   81.6839      
1 1 1 13 9  10 o 0 20.0509  0.326324  0.0923872    1.98632      0.670534     0.00994645   96.5034    91.6744      38.2412   90.9718      
1 1 1 13 9  11 o 0 20.2196  0.141941  -0.268154    0.0965656    0.21234      0.286087     94.3574    32.5169      33.3028   33.3358      
1 1 1 13 9  12 o 0 44.8131  1.14693   0.731314     2.60152      0.156632     -0.187956    186.436    55.4467      24.6534   59.7102      
1 1 1 13 9  13 o 0 23.7329  1.49411   11.9517      6.16791      -2.70294     -2.62995     91.852     81.2169      40.6145   0.367402     
1 1 1 13 10 0  o 0 17.7651  0.145163  2.00138e-17  0.06537      0            0            66.7129    90           6.83127   -90          
1 1 1 13 10 1  f 1 5.50677  0.138969  2.0479       -2.92616     1.25502      3.12702      30.8722    -81.3841     49.2243   -50.8609     
1 1 1 13 10 2  o 0 5.08192  0.127713  0.178096     1.15595      19.3702      -2.01112     18.6017    -123.983     35.7177   -70.3509     
1 1 1 13 10 3  o 0 19.1698  0.570093  13.4845      0.214976     -3.58471     -0.0224492   74.033     -1.39199     10.1683   6.94108      
1 1 1 13 10 4  o 0 41.7675  1.48736   -9.22355     -46.3569     11.4209      -5.25483     169.861    -71.1144     32.98     -84.9531     
1 1 1 13 10 5  o 0 4.35302  0.145859  0.191017     0.51605      0.645598     -0.664152    11.3131    79.2388      24.8108   39.9998      
1 1 1 13 10 6  o 0 4.76521  0.143498  -0.411174    0.241619     -0.368369    0.876572     10.1189    149.957      37.775    -157.945     
1 1 1 13 10 7  o 0 32.0299  0.867797  -5.65261     7.0865       0.860439     2.45193      138.628    159.619      21.3101   159.783      
1 1 1 13 10 8  o 0 5.5787   1.03811   4.2347       -31.2901     11.6756      3.37685      5.40669    155.901      38.4918   100.487      
1 1 1 13 10 9  o 0 5.9083   0.51458   5.28359      0.345143     -1.34385     -0.210438    14.7105    2.07536      11.7637   169.882      
1 1 1 13 10 10 o 0 6.14802  1.46305   4.91515      10.1223      1.4495       -1.99721     20.6742    74.3687      14.3506   167.336      
1 1 1 13 10 11 o 0 22.4955  0.211887  0.983726     -1.15192     1.14377      0.336402     77.2303    14.902       23.8465   -128.972     
1 1 1 13 10 12 f 1 12.4459  0.259673  0.271642     0.446407     0            0            51.7742    70.2408      12.6706   65.999       
1 1 1 13 11 0  o 0 10.0548  0.151844  -1.42472e-17 -0.077558    0            0            22.0234    90           10.2152   90           
1 1 1 13 11 1  o 0 35.7788  0.199933  -1.95337     -1.13425     -1.55587     -1.00309     171.976    124.373      49.8096   125.121      
1 1 1 13 11 2  o 0 15.2349  0.550094  5.5762       2.73754      -1.21252     -1.87837     53.5544    29.5651      12.495    -138.133     
1 1 1 13 11 3  o 0 15.6447  1.04154   24.4763      -2.06914     -7.54028     1.03227      57.175     -35.1725     26.4053   76.1381      
1 1 1 13 11 4  o 0 39.1831  0.408655  -2.90186     1.77092      -0.976913    1.09204      174.131    177.067      29.7644   179.455      
1 1 1 13 11 5  o 0 34.4775  0.927566  -7.51247     8.8585       0.888374     3.0383       139.291    152.512      2.28439   -115.383     
1 1 1 13 11 6  o 0 17.6259  0.114633  3.0692       0.667252     -7.97719     -0.726573    54.9637    91.2857      36.6914   -123.497     
1 1 1 13 11 7  o 0 16.2857  1.11842   5.86001      3.5653       -0.861127    -1.21447     69.1803    39.5318      11.1041   45.4082      
1 1 1 13 11 8  o 0 20.215   0.22607   0.392761     0.642713     -0.0390513   -0.357302    101.853    83.1381      46.3329   85.1849      
1 1 1 13 11 9  o 0 9.93144  1.14992   -9.64282     3.60649      -2.54869     1.81964      36.3747    130.97       6.28314   -119.7       
1 1 1 13 11 10 o 0 10.4991  0.830269  4.70743      -0.837133    -1.40043     0.318119     30.8057    15.5301      17.6577   -141.226     
1 1 1 13 12 0  o 0 42.3048  0.340007  -4.83328e-17 -0.263112    0            0            176.458    90           7.39082   90           
1 1 1 13 12 1  o 0 16.6787  1.25292   -1.77982     -28.9745     7.49461      -0.688326    48.9065    -81.5825     38.7602   111.825      
1 1 1 13 12 2  f 1 24.0723  0.243784  -0.0523637   -2.13752     1.32544      0.190006     124.285    -23.0544     52.7594   -22.6556     
1 1 1 13 12 3  f 1 15.8205  0.371675  0.595207     0.553337     0.00915561   -0.0685536   77.6589    31.2538      30.5235   32.4391      
1 1 1 13 12 4  o 0 5.27633  0.561709  -2.01534     -2.48634     0.365358     -1.1007      13.5327    -128.977     10.8784   112.643      
1 1 1 13 12 5  o 0 17.9158  1.50717   2.19312      14.3073      2.86717      -0.582639    69.521     102.856      19.8489   4.84388      
1 1 1 13 12 6  o 0 16.566   0.38433   -1.63843     0.489882     -0.563674    0.156222     74.0266    97.992       19.6513   120.899      
1 1 1 13 12 7  o 0 11.9708  0.219523  0.437586     1.71664      2.26884      0.166815     42.3497    13.8711      16.5996   131.932      
1 1 1 13 12 8  o 0 27.098   0.268563  0.744044     0.336849     0            0            121.087    -21.5575     28.6264   -16.7592     
1 1 1 13 13 0  o 0 6.33246  0.16913   4.75257e-17  0.155231     0            0            24.9231    90           7.89413   -90          
1 1 1 13 13 1  f 1 8.71883  0.0974833 -0.0143306   0.196843     0.0670139    -0.0474821   37.4081    153.022      14.5247   146.129      
1 1 1 13 13 2  o 0 13.208   0.330783  -1.41533     0.623194     -0.93207     0.366468     56.7815    124.592      13.4407   83.1946      
1 1 1 13 13 3  o 0 4.79509  0.166037  0.00545313   0.0276564    0.0327425    0.026709     4.17611    112.221      11.9815   -63.9484     
1 1 1 13 13 4  o 0 2.83388  0.771091  -3.62927     -0.772921    -0.831197    -0.327257    13.9044    168.02       17.2955   130.617      
1 1 1 13 13 5  o 0 14.3534  0.901697  -0.338175    3.46044      0.529866     0.202172     61.8973    118.911      13.7285   88.5033      
1 1 1 13 13 6  o 0 6.11555  0.190212  -0.00706184  -0.36464     0            0            7.72623    53.1696      23.9149   -107.973     
1 1 1 14 0  0  o 0 37.5007  0.540154  0.146097     0            0            0            135.816    0            25.9134   -180         
1 1 1 14 0  1  o 0 9.3488   0.224519  2.52972e-17  0.0826269    0            0            20.0604    90           5.68507   90           
1 1 1 14 0  2  o 0 9.76729  0.205514  0.0697685    0            0            0            35.4076    0            64.4341   180          
1 1 1 14 0  3  o 0 13.2174  0.145913  -1.50847e-19 -0.000821174 0            0            46.2123    90           12.1388   90           
1 1 1 14 0  4  o 0 44.6677  0.295789  -0.393204    4.81536e-17  0            0            161.865    180          57.8538   -0           
1 1 1 14 0  5  o 0 58.8116  0.378435  -7.98963e-17 -0.434935    0            0            212.834    -90          21.2543   90           
1 1 1 14 0  6  o 0 14.7037  0.144789  -0.215186    2.63526e-17  0            0            53.0979    180          35.2005   -0           
1 1 1 14 0  7  o 0 8.88257  0.138547  -1.02377e-17 -0.0557314   0            0            28.3958    90           8.48106   -90          
1 1 1 14 0  8  o 0 6.253    0.17873   0.0172876    0            0            0            1.30038    -180         1.37827   1.3083e-13   
1 1 1 14 0  9  o 0 22.709   0.174791  -2.90095e-18 -0.015792    0            0            81.0493    90           17.7961   90           
1 1 1 14 0  10 o 0 31.5911  0.220043  0.274415     0            0            0            112.097    180          16.9209   -180         
1 1 1 14 0  11 o 0 6.95701  0.175207  1.03125e-17  0.0336832    0            0            19.3945    90           3.29981   -90          
1 1 1 14 0  12 o 0 21.0119  0.172293  0.226678     0            0            0            81.2983    180          1.86966   -180         
1 1 1 14 0  13 o 0 7.28697  0.18725   1.39631e-17  0.045607     0            0            26.1998    90           11.6496   -90          
1 1 1 14 0  14 o 0 4.65833  0.35784   0.0510664    0            0            0            9.65009    180          7.14361   -0           
1 1 1 14 1  0  o 0 34.3526  0.249975  0.333262     0            0            0            124.623    0            24.7107   4.23082e-14  
1 1 1 14 1  1  f 1 19.4627  0.22516   11.9944      -2.02666     -20.0694     5.34         80.2293    -90.08       20.2687   -99.6794     
1 1 1 14 1  2  o 0 32.6093  1.24748   20.774       -25.9116     1.70042      6.6964       95.9511    -57.3884     43.795    106.444      
1 1 1 14 1  3  o 0 21.0213  0.878208  16.2468      12.0656      -1.43919     -4.31347     56.4096    40.8126      36.0924   -139.012     
1 1 1 14 1  4  o 0 37.6169  0.21515   1.36484      3.1011       1.82202      -3.07158     140.063    127.919      17.6339   -177.134     
1 1 1 14 1  5  o 0 19.7879  1.94469   105.33       18.5895      -21.331      -7.61912     76.9279    -1.42757     72.4961   -67.9934     
1 1 1 14 1  6  o 0 39.8208  0.211289  -0.602017    0.0149508    7.24497      1.71939      165.112    -174.419     44.6429   -168.283     
1 1 1 14 1  7  o 0 19.4941  0.64542   -27.4216     3.9188       -7.84635     2.138        43.6139    145.561      51.5047   -48.8265     
1 1 1 14 1  8  o 0 8.48086  0.971605  22.0164      -17.2744     -1.20423     4.81013      28.7223    -18.65       24.9446   61.2544      
1 1 1 14 1  9  o 0 7.85222  0.481372  11.6884      7.54882      -2.06601     -4.68123     19.2565    17.498       11.5422   150.776      
1 1 1 14 1  10 o 0 54.1416  0.729996  -6.61815     -5.57546     -0.407924    -1.34925     203.769    -141.275     24.5064   -138.628     
1 1 1 14 1  11 o 0 13.0489  1.29869   -83.0963     -14.1029     -23.9679     -8.14379     20.8899    159.763      47.7778   -7.12363     
1 1 1 14 1  12 o 0 34.2311  0.211975  1.74131      -2.76275     1.24485      1.34043      142.935    -11.8897     23.8183   0.0388585    
1 1 1 14 1  13 o 0 9.45668  0.368995  -5.37114     1.10144      -2.32608     1.10953      38.7013    121.127      13.0319   150.857      
1 1 1 14 1  14 o 0 20.1745  0.520987  -1.09157     1.01425      -0.261589    0.400873     87.7869    146.95       25.9638   142.609      
1 1 1 14 1  15 f 1 10.9297  0.949157  -2.50007     -1.95176     -0.0501489   -0.556066    46.009     173.666      23.5851   -140.649     
1 1 1 14 2  0  o 0 20.1594  0.164823  -0.156671    1.91867e-17  0            0            73.256     180          4.58213   -5.33752e-13 
1 1 1 14 2  1  o 0 44.9085  1.43628   -40.0179     -16.8307     -8.34274     -7.94194     165.917    -133.631     7.7528    -145.727     
1 1 1 14 2  2  o 0 37.9036  0.658232  -15.1446     -10.813      -1.56871     -5.55897     130.993    -178.979     11.1806   7.50162      
1 1 1 14 2  3  o 0 39.6128  1.21173   -1.11272     41.8145      9.68379      0.830567     157.866    62.8727      43.4001   106.229      
1 1 1 14 2  4  o 0 15.7011  1.35814   -35.9914     53.4375      6.05452      15.3011      40.7218    120.094      29.2343   -72.7734     
1 1 1 14 2  5  o 0 10.1928  1.12948   38.675       -16.2165     -6.60419     6.80946      63.3106    -17.514      60.2162   -2.77427     
1 1 1 14 2  6  o 0 19.561   1.45921   5.735        -54.1595     12.4915      2.49207      101.159    -92.4183     89.4585   -57.3563     
1 1 1 14 2  7  o 0 50.6705  0.288607  -1.26255     -0.208393    1.77363      -3.87506     164.281    150.948      35.1157   -26.1983     
1 1 1 14 2  8  o 0 18.2002  0.614033  11.4336      -1.74598     -2.44142     0.686666     71.2229    7.46166      22.9277   -31.7969     
1 1 1 14 2  9  o 0 48.4139  1.2726    -1.87878     19.1798      3.83559      0.543395     180.045    121.335      19.6142   88.3603      
1 1 1 14 2  10 o 0 25.2481  0.167202  -1.23169     1.00589      3.28844      9.34431      86.3455    -147.643     9.59151   89.6007      
1 1 1 14 2  11 o 0 13.212   0.533295  8.46124      -2.72251     -1.38811     0.958228     40.0472    -29.2788     16.6296   89.9937      
1 1 1 14 2  12 o 0 26.2393  0.663131  0.0322162    -8.81986     3.63604      0.376216     112.782    -32.8678     25.7849   -45.4869     
1 1 1 14 2  13 o 0 13.8755  0.509153  -2.47574     -6.73898     1.90024      -1.75677     58.1614    -137.397     17.2632   -140.074     
1 1 1 14 2  14 o 0 21.2379  0.745682  -3.21326     -0.782679    -0.485313    -0.504068    73.1252    176.276      12.7635   -1.29478     
1 1 1 14 2  15 o 0 34.0206  0.634715  1.24606      0.437195     0            0            133.264    25.6485      12.2954   23.3908      
1 1 1 14 3  0  o 0 9.74166  0.141638  -0.0792767   9.70859e-18  0            0            31.6226    180          0.328488  -180         
1 1 1 14 3  1  f 1 21.8276  1.04002   28.4495      -20.2921     -2.69796     8.29204      86.2114    -19.7131     21.7606   -54.6446     
1 1 1 14 3  2  f 1 51.815   1.20689   -35.0215     9.77008      -11.7048     8.32738      172.485    -150.64      35.5809   -2.85275     
1 1 1 14 3  3  o 0 35.521   1.16027   11.6716      34.3229      8.28608      -5.93925     113.252    77.0439      28.8713   -98.2476     
1 1 1 14 3  4  o 0 21.6998  0.285423  -9.4735      -5.57944     -5.85792     -9.61443     76.151     -78.7833     15.7031   179.364      
1 1 1 14 3  5  o 0 13.5423  0.107778  -1.53379     -1.28693     -4.31623     -11.1504     64.0416    101.079      66.7941   52.9583      
1 1 1 14 3  6  f 1 28.2794  0.150576  0.0443522    0.353681     1.75883      3.27988      112.836    48.3152      50.8374   -7.05083     
1 1 1 14 3  7  o 0 26.7927  0.473254  -5.69828     6.48229      0.425035     2.39004      112.649    -165.629     62.2712   145.82       
1 1 1 14 3  8  o 0 35.4226  1.51942   55.2296      0.864554     -12.9114     -0.0908686   136.9      4.38074      22.5706   8.90022      
1 1 1 14 3  9  o 0 14.1953  0.28029   -4.38584     -9.26068     6.66932      -7.48612     50.7832    -30.7682     21.2304   49.58        
1 1 1 14 3  10 o 0 17.4633  0.292631  -10.5363     -1.67982     -9.1632      -3.71002     66.8291    110          30.506    47.4585      
1 1 1 14 3  11 o 0 22.7079  0.636361  -7.08466     -4.28833     -1.05406     -2.58991     118.726    -175.666     66.0851   -178.767     
1 1 1 14 3  12 o 0 17.0187  0.409474  -5.43621     -0.168617    -1.93221     0.105853     53.2404    -128.338     28.4617   94.7011      
1 1 1 14 3  13 o 0 14.304   0.770644  5.69745      -7.03569     0.415378     1.64889      55.2792    -52.8181     4.98306   -27.679      
1 1 1 14 3  14 o 0 14.0262  0.177387  -0.705482    -0.647199    -2.28425     -0.575216    31.0125    -87.3587     42.615    89.1117      
1 1 1 14 3  15 o 0 9.31287  1.03314   1.00817      5.48338      1.25129      -0.327186    34.4995    58.4324      10.8522   124.888      
1 1 1 14 4  0  o 0 14.8862  0.169361  0.0569271    0            0            0            53.9245    0            11.7359   3.00797e-13  
1 1 1 14 4  1  o 0 38.683   0.222481  3.54085      5.2222       1.76339      -6.66217     132.533    123.018      34.0036   -124.034     
1 1 1 14 4  2  o 0 84.8414  0.402392  -7.92859     -1.39862     -4.73026     0.0691449    314.6      -109.449     12.6539   -125.227     
1 1 1 14 4  3  o 0 51.8764  1.83542   -6.33411     64.7662      15.3304      2.40289      211.708    91.7382      48.5423   98.8233      
1 1 1 14 4  4  o 0 13.4137  1.27073   56.1906      -21.4785     -11.38       10.0371      45.8258    -28.7066     41.8188   -109.426     
1 1 1 14 4  5  o 0 21.8747  0.676595  10.7434      -15.41       1.28026      3.77636      43.6167    -63.0353     69.1832   105.755      
1 1 1 14 4  6  o 0 27.0379  0.143564  0.0507679    -1.00034     0.21356      0.0324509    66.0363    -4.19842     61.0833   -173.651     
1 1 1 14 4  7  o 0 43.1539  1.71239   5.42816      -65.3386     13.8035      1.79948      175.64     -77.2829     42.8196   -82.4281     
1 1 1 14 4  8  o 0 19.0798  1.13599   -37.1452     7.14535      -8.46498     3.24282      80.9268    174.268      31.9936   154.545      
1 1 1 14 4  9  f 1 34.962   1.42226   -9.91739     64.4676      15.34        5.15991      162.312    118.575      78.2906   111.035      
1 1 1 14 4  10 o 0 9.53853  0.102256  0.297843     0.0479749    -6.2423      3.5202       47.2378    79.5432      39.0438   89.2153      
1 1 1 14 4  11 o 0 30.7516  0.162363  0.184814     -0.0457783   -0.0525165   -0.303291    118.445    163.006      3.03709   72.3349      
1 1 1 14 4  12 o 0 9.58031  0.195598  0.589156     0.305789     -0.0902568   -0.176554    22.1213    -21.6526     23.9974   140.011      
1 1 1 14 4  13 o 0 19.9388  0.807207  -2.58419     4.87375      1.44444      1.37386      93.6636    163.003      37.7205   160.791      
1 1 1 14 4  14 o 0 19.3678  0.517288  -3.58485     -0.996825    -1.19927     -0.285815    72.9597    163.188      2.77749   -156.181     
1 1 1 14 4  15 o 0 35.7093  0.833585  -3.03604     6.79206      2.23738      0.741072     135.218    150.004      3.81843   159.319      
1 1 1 14 5  0  o 0 23.0087  0.202481  0.0443215    0            0            0            83.9574    0            49.8152   -3.57075e-14 
1 1 1 14 5  1  f 1 37.8629  0.279588  -1.44858     -2.9715      3.63904      -2.71427     131.559    174.165      13.0547   24.7345      
1 1 1 14 5  2  o 0 26.7428  0.148316  6.62769      0.652348     -22.5833     0.185533     90.2215    66.5927      81.0247   -20.7203     
1 1 1 14 5  3  o 0 58.4761  0.276108  -1.34993     -3.40412     10.1479      -1.15079     220.062    -175.611     19.5304   147.627      
1 1 1 14 5  4  o 0 14.0476  0.65961   -29.4208     -3.62227     -11.289      -2.94703     63.6156    -137.732     44.6683   177.559      
1 1 1 14 5  5  o 0 23.0537  0.127856  -0.0106475   -1.10522     2.9815       0.915951     89.1041    -173.371     39.3926   -110.554     
1 1 1 14 5  6  o 0 14.1825  0.23586   4.87643      2.85699      -1.45749     -2.81401     53.0457    -28.5174     8.07175   -4.12629     
1 1 1 14 5  7  o 0 67.583   0.929687  -6.87558     -11.641      1.09318      -2.77478     251.811    -125.94      18.6472   -116.826     
1 1 1 14 5  8  o 0 28.1189  1.19285   -66.8123     -19.3798     -19.4843     -11.8426     125.878    -124.747     60.417    -152.736     
1 1 1 14 5  9  o 0 5.92397  0.89147   4.73586      31.7659      8.06863      -2.41724     44.0497    107.134      71.3158   133.519      
1 1 1 14 5  10 o 0 14.2828  0.216931  3.77487      -1.11076     -4.80062     1.94619      73.0504    68.3425      37.7105   80.6409      
1 1 1 14 5  11 o 0 26.5646  0.914695  8.26828      -1.85629     -1.07862     0.641539     99.3978    -45.4274     19.636    57.4453      
1 1 1 14 5  12 f 1 24.9993  0.189026  -2.4704      -1.94958     0.488355     -3.88006     98.9399    144.267      13.456    -157.01      
1 1 1 14 5  13 o 0 19.0609  0.43632   -0.857562    -2.13189     0.67352      -0.287143    82.5719    -153.332     22.7476   -150.433     
1 1 1 14 5  14 o 0 12.6698  1.43271   12.0516      4.59237      -2.52007     -1.86832     37.666     38.9824      18.2485   -124.175     
1 1 1 14 6  0  o 0 5.90762  0.172618  0.0098035    0            0            0            0.88589    0            0.311616  -180         
1 1 1 14 6  1  o 0 13.6635  0.595983  -5.53167     16.5606      5.13509      3.97823      50.7472    146.728      14.2308   81.2599      
1 1 1 14 6  2  f 1 32.6873  0.408119  -17.5807     8.2948       -10.5445     11.1711      117.237    92.3083      67.9389   176.675      
1 1 1 14 6  3  o 0 9.54309  1.35732   -4.3835      77.6277      20.4755      2.41603      40.0159    91.2246      14.868    87.4745      
1 1 1 14 6  4  o 0 10.5144  0.900464  -43.2044     -11.5556     -10.7587     -6.30624     30.7333    -167.051     16.8266   -46.6442     
1 1 1 14 6  5  o 0 31.0398  0.166175  2.85742      1.72616      -0.785386    -2.41028     121.486    -34.1574     20.8667   -36.0212     
1 1 1 14 6  6  o 0 23.5597  1.01709   -6.97076     33.4754      9.38455      3.77166      108.784    85.8839      52.3072   85.9357      
1 1 1 14 6  7  o 0 45.0806  1.27903   20.9965      -34.2213     4.86143      10.9167      193.614    -92.8573     64.3971   -91.8028     
1 1 1 14 6  8  o 0 23.5527  0.680282  -22.8933     8.39322      -5.43641     4.81621      73.8169    -166.258     20.3424   36.2116      
1 1 1 14 6  9  o 0 15.725   0.467406  0.0948895    -9.08593     6.58236      0.636221     68.1302    -155.829     14.615    -144.057     
1 1 1 14 6  10 o 0 26.5254  0.615854  -3.49666     -7.01302     1.06361      -1.67103     93.0105    -158.03      22.2678   -11.0249     
1 1 1 14 6  11 o 0 18.4339  0.398612  7.10882      1.39833      -3.64975     -1.10436     82.5851    73.2608      39.6764   27.0623      
1 1 1 14 6  12 o 0 10.8808  0.889496  2.60248      -4.05001     0.645225     1.07261      56.5072    -106.095     41.5168   -78.6995     
1 1 1 14 6  13 o 0 14.883   0.888175  3.84424      -3.42157     0.197991     2.08078      49.3535    17.2449      42.8859   -78.2879     
1 1 1 14 6  14 o 0 5.18652  0.42624   0.0728887    0.10284      0            0            6.12267    -40.0079     7.47472   105.795      
1 1 1 14 7  0  o 0 22.2957  0.169148  0.119857     0            0            0            81.8962    180          9.48555   -180         
1 1 1 14 7  1  o 0 6.16069  0.539216  -22.8806     -13.5473     -7.61369     -13.5654     31.8369    -141.561     53.3377   176.855      
1 1 1 14 7  2  o 0 23.6586  1.05074   38.1655      15.3637      -7.83844     -7.81399     73.861     -0.464566    30.2232   134.885      
1 1 1 14 7  3  o 0 24.3885  1.1444    -4.58236     51.0238      10.9867      2.17554      82.1101    98.1752      19.2347   -23.2647     
1 1 1 14 7  4  o 0 11.2296  0.104137  5.94892      -3.84223     -3.35606     6.69611      38.0731    44.1071      4.34874   -141.405     
1 1 1 14 7  5  o 0 33.6322  0.160415  -12.9963     3.85911      -7.18265     4.15197      140.783    92.8215      49.5599   127.478      
1 1 1 14 7  6  f 1 42.5166  0.577226  -10.1742     -22.2813     6.42503      -6.55466     127.813    -159.747     50.4758   25.0488      
1 1 1 14 7  7  o 0 23.0702  0.453283  11.695       5.83835      -8.811       -10.2383     100.993    -50.9757     37.2496   -51.661      
1 1 1 14 7  8  o 0 26.8258  0.20803   -3.1971      -0.952213    -3.06578     -4.10754     113.363    128.916      21.4115   91.2675      
1 1 1 14 7  9  f 1 31.9689  0.442145  -1.17462     2.06814      0.280963     0.359681     144.056    30.0923      41.2716   45.0216      
1 1 1 14 7  10 o 0 30.0757  0.938047  -5.98739     10.2783      1.31455      2.9021       141.718    116.517      52.202    113.725      
1 1 1 14 7  11 o 0 19.4786  0.233817  2.53319      -0.64731     -2.92545     -1.20954     72.3571    -66.8982     6.59182   163.673      
1 1 1 14 7  12 o 0 23.8346  0.243611  1.24728      1.01919      1.62477      -0.964572    106.325    107.64       33.7882   119.669      
1 1 1 14 7  13 f 1 12.0167  0.236626  0.127319     -0.199771    0            0            44.0213    -129.985     3.0034    -83.1671     
1 1 1 14 8  0  o 0 35.6553  0.254797  -0.264369    3.23759e-17  0            0            131.304    0            35.4067   180          
1 1 1 14 8  1  o 0 41.3152  0.188961  0.458798     -0.948787    -4.60021     5.37935      147.811    -99.8108     35.7265   163.141      
1 1 1 14 8  2  o 0 24.8776  0.526969  -15.3134     18.3105      2.10963      9.64631      83.9869    77.8042      26.9173   -167.689     
1 1 1 14 8  3  o 0 13.5181  0.683566  1.53258      13.7783      2.50308      -0.597736    63.2418    90.963       34.2943   74.5187      
1 1 1 14 8  4  o 0 22.4296  0.153277  4.30213      7.2259       3.73981      -5.95655     69.4834    -12.5043     37.1487   -134.128     
1 1 1 14 8  5  o 0 32.3562  0.680629  8.18886      -0.271599    -9.18261     1.81126      96.9084    71.944       39.9878   -100.054     
1 1 1 14 8  6  o 0 22.5684  1.24404   -3.30914     43.2116      11.7039      2.27672      106.122    68.1544      35.6059   79.7465      
1 1 1 14 8  7  f 1 17.1324  0.852202  -16.6972     7.52578      -3.61442     3.79891      82.2548    -177.496     34.6528   166.335      
1 1 1 14 8  8  o 0 43.4183  0.238622  0.355655     -0.901377    0.550163     0.267753     179.272    172.395      18.4914   -168.028     
1 1 1 14 8  9  o 0 11.1507  0.196586  -1.1471      -1.65567     0.281552     -1.22438     56.7221    161.969      32.4463   175.002      
1 1 1 14 8  10 o 0 38.5663  0.242595  -1.34231     -0.025881    1.45686      0.912629     159.554    -169.155     19.9929   -165.65      
1 1 1 14 8  11 o 0 8.86462  0.259795  -1.21058     -0.386028    -2.42331     -0.0647353   27.487     108.444      21.7827   -140.26      
1 1 1 14 8  12 o 0 15.8901  1.32476   1.903        -10.958      2.24491      1.12065      51.6174    -86.6908     15.8103   105.256      
1 1 1 14 9  0  o 0 36.2105  0.234595  -0.30719     3.76199e-17  0            0            133.69     180          11.8218   -180         
1 1 1 14 9  1  f 1 11.5401  0.878186  52.7782      5.75255      -18.1354     -3.83051     34.0631    -28.9873     18.1158   115.513      
1 1 1 14 9  2  o 0 37.8336  0.522002  -0.922325    4.18683      1.04895      0.254998     149.657    61.1385      24.1224   68.9638      
1 1 1 14 9  3  o 0 6.23181  0.292047  0.578548     -0.68422     0.0107711    0.1206       19.1707    -44.7424     6.57981   -75.9525     
1 1 1 14 9  4  o 0 25.1852  1.02481   -0.491836    -10.3346     2.15623      -0.348242    115.379    -65.328      32.553    -80.595      
1 1 1 14 9  5  o 0 36.5519  0.969268  24.402       0.293443     -6.34151     -0.585313    161.783    -34.4744     34.386    -15.8353     
1 1 1 14 9  6  o 0 28.2802  0.461343  0.498288     -0.963735    5.7805       -3.05742     146.838    168.402      70.1564   166.935      
1 1 1 14 9  7  f 1 25.0361  0.859613  20.3591      -3.32002     -6.12018     1.64484      77         -46.7887     43.6937   119.653      
1 1 1 14 9  8  o 0 6.24853  0.322909  0.0710754    1.5904       0.323007     -0.0154737   10.2497    80.3103      27.8495   -151.995     
1 1 1 14 9  9  o 0 31.3847  0.925163  1.29028      3.19649      0.253556     -0.483619    122.987    68.2244      2.32202   102.374      
1 1 1 14 9  10 o 0 27.2256  1.21368   0.922247     7.45311      1.41043      -0.779127    119.815    71.0823      30.7614   78.95        
1 1 1 14 9  11 o 0 20.1766  0.834807  -7.56603     -0.508569    -3.20246     -1.55968     80.8234    142.967      15.9378   88.0538      
1 1 1 14 10 0  o 0 21.4849  0.163976  0.261577     0            0            0            87.974     180          17.111    -9.71628e-14 
1 1 1 14 10 1  o 0 17.9268  0.581096  10.0938      1.45042      -3.13553     -0.733185    90.7176    47.0152      40.3486   37.0405      
1 1 1 14 10 2  o 0 16.6606  0.558202  3.21926      6.76478      1.48579      -1.60902     77.998     98.2549      27.0906   82.5354      
1 1 1 14 10 3  o 0 25.9748  0.573468  0.767993     -8.00114     1.5427       0.443841     117.59     -63.2214     29.37     -76.6093     
1 1 1 14 10 4  o 0 24.7606  0.136197  -0.52151     0.255286     1.83104      1.9721       113.588    25.9572      30.5658   26.423       
1 1 1 14 10 5  o 0 24.81    0.421237  -5.74856     2.48439      -2.73422     4.24368      97.4102    -142.08      14.389    -44.7195     
1 1 1 14 10 6  o 0 21.5771  0.134167  -0.779402    -1.52121     8.19507      -1.91171     87.8878    175.929      10.7946   115.249      
1 1 1 14 10 7  o 0 14.6917  0.554849  2.9541       0.990346     -0.574361    -0.78383     68.8228    58.7785      26.8505   51.1226      
1 1 1 14 10 8  o 0 2.99917  0.295256  -1.40561     -0.66332     -0.549072    -0.847245    8.53414    -150.845     9.18373   -118.855     
1 1 1 14 10 9  o 0 19.8811  0.364812  1.23112      -0.968779    0.142841     0.718043     88.7087    21.2132      25.4785   14.1482      
1 1 1 14 10 10 o 0 15.8149  0.194863  0.240518     0.782896     0.859234     2.07401      48.5991    38.2099      23.8998   -126.838     
1 1 1 14 11 0  o 0 4.97996  0.193165  0.0327846    0            0            0            2.98028    -180         1.62024   1.13504e-13  
1 1 1 14 11 1  o 0 18.1592  0.253953  -5.17176     1.86805      -2.30955     2.37033      102.055    83.0536      62.3373   99.6363      
1 1 1 14 11 2  o 0 26.4592  0.206102  3.30136      -0.514216    -2.95769     2.36871      113.012    60.084       12.9157   46.5682      
1 1 1 14 11 3  o 0 17.8054  0.35468   -0.370757    -1.82289     0.728095     0.0236982    72.0766    -133.127     4.42466   -172.426     
1 1 1 14 11 4  f 1 29.6365  0.447632  -2.78772     -0.68656     -0.703377    -0.858729    117.121    150.066      2.69038   -25.9178     
1 1 1 14 11 5  o 0 14.201   1.00995   5.73338      1.67169      -1.39863     -0.593557    66.002     33.5486      23.2171   35.1391      
1 1 1 14 11 6  o 0 33.1596  0.538812  -0.268342    2.62501      0.583379     -0.213297    125.246    80.4493      12.2828   -112.849     
1 1 1 14 11 7  f 1 13.8699  0.12757   0.248259     0.491779     -0.0503311   2.08146      53.4735    47.6106      3.04575   -43.7907     
1 1 1 14 11 8  o 0 19.3781  1.14561   6.44182      -1.23338     -1.14847     0.268384     75.4924    -22.0365     1.85223   7.4678       
1 1 1 14 12 0  o 0 2.82843  0.301889  -0.0378924   4.64048e-18  0            0            4.16206    0            14.4641   -180         
1 1 1 14 12 1  f 1 20.0124  0.254005  0.506003     0.604632     0.314243     -0.32269     78.7717    54.3807      4.00254   -83.8955     
1 1 1 14 12 2  o 0 26.8969  0.195387  0.121426     0.696182     -0.765255    -0.427488    122.873    121.934      29.9214   109.694      
1 1 1 14 12 3  f 1 8.81295  0.875086  -0.047289    -7.26267     2.40831      -0.27684     4.36798    -12.5244     63.8662   98.7501      
1 1 1 14 12 4  o 0 17.8567  0.864023  -3.15916     2.05102      -0.461384    0.620469     70.735     102.885      10.0968   -172.829     
1 1 1 14 12 5  o 0 28.3417  0.745127  -0.079883    3.59572      0.665832     0.345467     118.515    9.93423      20.976    62.3083      
1 1 1 15 0  1  o 0 12.5419  0.2001    -1.04678e-17 -0.056984    0            0            40.1485    -90          15.1408   -90          
1 1 1 15 0  2  o 0 37.9157  0.300907  -0.438114    5.36535e-17  0            0            134.516    180          3.30058   -180         
1 1 1 15 0  3  f 1 42.4511  0.323778  -1.06766e-16 -0.581209    0            0            150.476    -90          13.5814   90           
1 1 1 15 0  4  f 1 55.9017  0.360801  -0.249092    3.05049e-17  0            0            197.871    0            3.42183   180          
1 1 1 15 0  5  o 0 13.6015  0.138278  -1.81643e-17 -0.0988819   0            0            47.5077    -90          7.38122   -90          
1 1 1 15 0  6  o 0 23.3517  0.184814  0.108682     0            0            0            82.252     180          17.0345   -180         
1 1 1 15 0  7  o 0 38.713   0.259153  1.15556e-16  0.377435     0            0            135.869    90           51.0152   90           
1 1 1 15 0  8  f 1 40.8571  0.271098  0.449413     0            0            0            142.756    0            39.8252   1.80986e-14  
1 1 1 15 0  9  f 1 36.6087  0.272489  7.27034e-17  0.237467     0            0            127.233    90           0.142858  90           
1 1 1 15 0  10 f 1 24.978   0.253637  0.246752     0            0            0            95.443     180          35.7463   -180         
1 1 1 15 0  11 o 0 54.9955  0.401635  5.42188e-17  0.177092     0            0            208.651    90           12.1009   90           
1 1 1 15 0  12 o 0 7.48331  0.301627  -0.0608332   7.44992e-18  0            0            26.6037    180          0.245113  -1.97145e-12 
1 1 1 15 1  0  o 0 5.52268  0.225957  4.90339e-18  0.0160157    0            0            14.0255    -90          22.3506   90           
1 1 1 15 1  1  o 0 40.1971  1.14335   16.1547      11.8536      -1.86214     -5.13609     147.997    62.7258      12.6438   57.9834      
1 1 1 15 1  2  o 0 13.2252  1.5623    -13.9405     -102.988     29.9515      -8.02747     19.4195    -88.2866     68.9248   27.6767      
1 1 1 15 1  3  o 0 12.167   0.935886  40.9444      -1.06811     -17.1365     1.08301      41.4834    63.2692      35.2136   128.515      
1 1 1 15 1  4  f 1 32.4717  1.26831   12.6276      -41.7253     9.48989      6.61799      104.318    -100.449     28.1541   30.8461      
1 1 1 15 1  5  o 0 6.46923  0.430921  2.24907      -6.30338     1.4428       1.15437      22.586     -107.35      50.8245   -157.276     
1 1 1 15 1  6  o 0 35.785   0.340275  7.63273      1.5588       -2.1947      -1.17387     154.024    25.6838      59.8201   25.5106      
1 1 1 15 1  7  o 0 21.3218  0.489601  31.0591      10.1245      -14.5829     -11.3638     96.0698    77.6167      49.1241   52.9291      
1 1 1 15 1  8  o 0 13.6977  0.618978  0.0617723    -24.0036     11.4543      -0.128657    40.3197    -42.6293     23.5247   -163.085     
1 1 1 15 1  9  o 0 25.2366  0.137596  0.828098     -0.472553    -5.77478     -0.459558    81.651     -86.1578     12.7003   60.5372      
1 1 1 15 1  10 o 0 17.3288  0.131857  -0.121221    1.06869      2.26985      3.28713      59.9452    30.9262      11.8194   -120.679     
1 1 1 15 1  11 o 0 20.2953  0.653375  -0.613476    5.05425      0.886943     0.132767     97.4256    115.989      45.9447   111.293      
1 1 1 15 1  12 o 0 13.2595  0.553246  3.76115      2.72586      -0.346083    -0.871274    49.6814    17.7825      6.69098   73.6018      
1 1 1 15 1  13 o 0 13.4253  1.12482   -5.50147     -1.95539     -0.903084    -0.934116    39.4356    -139.745     20.0649   68.9031      
1 1 1 15 2  0  o 0 43.3382  0.291082  6.82097e-17  0.22279      0            0            154.584    -90          17.4936   -90          
1 1 1 15 2  1  o 0 15.9138  1.26306   -41.1857     43.7949      0.795889     14.9236      53.8595    130.42       4.30986   -117.598     
1 1 1 15 2  2  o 0 5.85469  1.26361   -26.0628     45.4416      6.84744      11.8037      6.9145     69.4471      32.3845   -38.2485     
1 1 1 15 2  3  o 0 25.7811  0.626828  -38.3238     -6.39408     -20.6833     -7.79146     69.9999    146.522      81.8769   -105.599     
1 1 1 15 2  4  o 0 23.6898  0.734824  14.7129      16.9346      0.90382      -5.56742     71.1283    36.2941      22.4888   -150.481     
1 1 1 15 2  5  o 0 19.1425  0.394265  6.14405      12.6271      6.88677      -9.57385     60.1337    136.429      14.6301   -59.3394     
1 1 1 15 2  6  o 0 32.3203  1.50815   -41.1056     20.4042      -6.40527     8.9682       119.804    140.25       19.4547   -178.317     
1 1 1 15 2  7  o 0 45.7892  0.537218  -4.66561     2.66899      -0.92816     3.86388      189.406    -146.068     58.2364   -146.897     
1 1 1 15 2  8  o 0 39.2999  0.415621  3.40946      -11.9071     5.77755      4.46199      165.516    -132.44      57.9038   -138.783     
1 1 1 15 2  9  o 0 16.3304  0.186555  2.06956      0.945089     -1.47546     -2.49906     74.7075    -46.3973     28.5228   -63.7812     
1 1 1 15 2  10 o 0 19.4029  0.649937  4.38335      6.07996      0.573555     -2.32121     61.1598    61.3746      22.6577   -130.399     
1 1 1 15 2  11 o 0 24.041   0.789696  1.88515      11.6346      3.88546      -0.906558    111.659    88.0637      46.1199   86.1022      
1 1 1 15 2  12 o 0 12.9773  0.833635  4.39441      -1.76073     -0.804752    1.05609      52.3647    -26.0138     12.7765   -12.3803     
1 1 1 15 2  13 o 0 16.9279  0.948628  -2.07735     2.05529      -0.0824871   0.467474     69.79      171.108      18.0291   151.095      
1 1 1 15 3  0  o 0 8.35464  0.147008  -1.03774e-17 -0.056492    0            0            23.4355    -90          3.10807   90           
1 1 1 15 3  1  o 0 18.4128  0.757241  -8.56925     -34.3533     17.2574      -9.65935     56.2666    -176.2       28.8627   60.5304      
1 1 1 15 3  2  o 0 24.2514  1.26075   25.4488      52.9693      9.31634      -11.2853     101.612    55.15        34.5259   61.5748      
1 1 1 15 3  3  f 1 19.139   0.234063  -3.58883     0.722368     -3.04459     1.67749      68.604     -123.329     32.6437   -48.2183     
1 1 1 15 3  4  o 0 53.4872  0.295242  -0.138956    1.26898      -1.77941     7.40731      204.35     43.8506      41.4374   85.5617      
1 1 1 15 3  5  o 0 23.8393  1.08704   -3.30607     -49.2598     12.0501      -1.4653      98.5749    -109.183     36.1411   -81.9812     
1 1 1 15 3  6  o 0 34.2497  0.325788  7.82875      2.4275       -13.1233     -5.67907     114.109    93.1806      19.1786   -37.4594     
1 1 1 15 3  7  o 0 40.3366  1.19748   18.8047      33.5807      5.06113      -9.07622     138.986    57.9539      5.0033    -154.704     
1 1 1 15 3  8  o 0 55.7286  0.820999  0.417185     8.60605      1.2641       -0.241625    201.124    105.067      13.2071   93.6214      
1 1 1 15 3  9  o 0 37.9585  0.313085  -1.85636     0.435206     -1.04115     0.0811552    180.038    147.675      70.4195   144.438      
1 1 1 15 3  10 o 0 11.8118  0.423673  -8.6363      0.631025     -4.51782     0.901528     59.28      -128.908     33.3798   -148.205     
1 1 1 15 3  11 o 0 16.4525  0.562179  1.0359       -8.69717     4.82754      0.62503      81.4828    -23.7989     40.2444   -24.4453     
1 1 1 15 3  12 o 0 9.9602   0.470926  2.56995      0.328076     -1.36035     -0.715663    42.4162    -27.9216     20.9496   -48.1622     
1 1 1 15 3  13 f 1 14.0091  1.51027   3.06589      6.35567      0.741887     -0.774961    32.918     68.428       36.8653   -98.1759     
1 1 1 15 3  14 o 0 13.1877  0.821508  0.424128     1.13325      0.123728     -0.0631777   50.0952    68.4214      7.3239    65.4371      
1 1 1 15 4  0  o 0 9.78264  0.155938  -1.95725e-17 -0.106548    0            0            34.2472    -90          13.7293   90           
1 1 1 15 4  1  o 0 26.7766  1.08154   17.7998      -46.1491     10.416       9.87982      97.8183    -46.7694     7.64596   -55.6178     
1 1 1 15 4  2  o 0 3.30373  0.528482  13.0878      -1.21597     -5.7112      1.02334      35.917     -2.33457     58.3187   0.886373     
1 1 1 15 4  3  o 0 9.7978   0.666939  15.9024      10.263       -2.12535     -4.86279     5.10871    52.0036      56.6511   -164.996     
1 1 1 15 4  4  f 1 23.4914  0.812728  -27.1943     2.34329      -7.31831     1.10542      104.644    155.326      47.1503   159.381      
1 1 1 15 4  5  o 0 57.2943  0.48356   -0.946617    28.5655      9.42661      1.2905       211.294    41.6757      20.5958   75.7486      
1 1 1 15 4  6  o 0 25.1392  1.29348   -86.5447     14.8674      -24.696      8.28581      85.3415    139.338      5.6184    -40.5779     
1 1 1 15 4  7  o 0 35.3118  0.418065  -3.30816     13.5982      5.708        3.46224      113.355    40.5967      28.9782   173.682      
1 1 1 15 4  8  o 0 32.5853  0.157392  -0.302572    0.24997      -0.611664    0.536474     147.806    -138.84      46.1261   -133.732     
1 1 1 15 4  9  o 0 16.4292  0.487963  1.40052      -4.79929     1.10414      0.784568     81.2908    -99.8908     42.8869   -96.353      
1 1 1 15 4  10 o 0 29.5478  0.750111  7.72558      -0.105956    -2.52297     -0.207253    106.529    7.74841      10.5493   -165.18      
1 1 1 15 4  11 o 0 21.2084  0.622973  1.88743      -10.8577     6.53165      3.26649      85.9482    -143.931     13.481    -167.696     
1 1 1 15 4  12 o 0 16.7215  0.198017  0.578079     -0.496332    -1.87136     -0.30894     58.2373    -79.0931     8.187     130.428      
1 1 1 15 4  13 o 0 15.468   0.18696   -0.282523    0.559764     0.624899     0.0174436    48.1125    174.116      16.6077   4.06469      
1 1 1 15 5  0  o 0 29.0276  0.234087  6.82218e-17  0.222829     0            0            104.325    90           44.8904   90           
1 1 1 15 5  1  o 0 37.0244  0.450764  0.807941     -22.3614     18.5446      2.98169      129.172    -160.157     27.0576   99.6118      
1 1 1 15 5  2  o 0 10.1993  0.251323  5.2674       0.707995     -2.49531     -0.594989    7.76705    168.049      83.3531   143.491      
1 1 1 15 5  3  o 0 10.5548  0.447587  -9.11827     -4.42405     -1.81642     -2.211       37.1406    -173.219     35.0323   -100.386     
1 1 1 15 5  4  o 0 35.8127  0.837377  -20.8278     -3.37737     -6.33742     -1.80447     124.275    -141.267     6.5633    -4.66474     
1 1 1 15 5  5  o 0 25.4238  0.665637  -7.07829     -29.0638     17.3861      -9.75461     100.544    -33.8614     29.8053   7.11099      
1 1 1 15 5  6  o 0 52.6546  0.376687  17.3251      2.56216      -8.79775     -3.97904     200.517    -49.728      29.749    -56.429      
1 1 1 15 5  7  o 0 29.4116  0.62774   -1.7567      13.0832      4.87123      1.86927      152.869    42.0765      80.2535   50.5534      
1 1 1 15 5  8  f 1 28.7731  0.553949  -1.1297      3.54722      0.632824     0.36456      121.047    102.173      22.1691   105.238      
1 1 1 15 5  9  o 0 14.7825  0.107695  0.0804505    0.173331     -0.119866    -0.886867    49.3062    121.095      13.1561   -93.2934     
1 1 1 15 5  10 o 0 32.1247  0.880061  -11.3022     -8.00187     -1.25509     -5.66786     144.444    177.967      46.1709   165.94       
1 1 1 15 5  11 o 0 23.0694  0.733463  -0.945701    -4.91613     2.1153       0.0936365    92.9032    -60.3314     13.4333   -58.0255     
1 1 1 15 5  12 o 0 13.7334  0.683272  -4.94659     0.509084     -1.77948     0.045436     56.8905    138.197      14.6409   130.458      
1 1 1 15 5  13 o 0 11.7106  0.836799  1.63063      -3.20076     0.336459     0.599188     56.8275    -117.473     38.6327   -88.3715     
1 1 1 15 6  0  o 0 6.37966  0.182785  2.353e-17    0.0768548    0            0            10.7649    90           0.282817  90           
1 1 1 15 6  1  o 0 17.6502  0.282332  1.42983      9.34376      6.10214      -1.6274      26.3014    15.4981      72.8918   -165.418     
1 1 1 15 6  2  o 0 22.669   0.350101  -12.503      -11.6767     -0.220049    -11.435      85.6324    160.033      26.8576   -135.692     
1 1 1 15 6  3  o 0 26.964   0.493627  12.2784      -5.85213     -2.82195     3.16564      100.852    -47.5423     12.5731   -68.1593     
1 1 1 15 6  4  o 0 8.52075  0.109425  -1.89413     1.18815      -4.48221     12.9278      10.7538    -111.159     13.1156   -84.5997     
1 1 1 15 6  5  o 0 16.1498  1.1749    -27.8391     46.203       6.38357      11.7777      54.146     122.594      3.76375   -93.5551     
1 1 1 15 6  6  o 0 6.18505  1.36155   -30.6146     1.14665      -7.69366     0.65594      30.9712    174.496      19.0358   154.324      
1 1 1 15 6  7  o 0 4.84815  0.758927  6.65336      8.05795      0.493025     -2.81344     10.6438    31.4228      16.9817   -85.2796     
1 1 1 15 6  8  o 0 12.4279  0.258748  0.847227     3.35158      2.09585      -0.909333    50.347     14.5336      11.5347   -23.8513     
1 1 1 15 6  9  o 0 20.6694  0.875289  -13.6894     5.06571      -4.23446     3.26508      83.9483    -167.935     13.4227   -139.899     
1 1 1 15 6  10 o 0 20.0451  1.16983   5.95838      -3.32963     -0.497037    1.34108      56.7916    -37.9748     37.8234   132.458      
1 1 1 15 6  11 o 0 4.99138  0.681005  -1.59025     3.78105      1.05018      1.29276      8.32047    108.565      20.3339   -3.79827     
1 1 1 15 6  12 o 0 10.6113  0.239552  -0.149185    0.250023     0            0            39.2017    -148.139     6.23298   -176.708     
1 1 1 15 7  0  o 0 2.40832  0.326376  -1.8186e-18  -0.00989998  0            0            2.07682    -90          13.005    90           
1 1 1 15 7  1  o 0 6.68294  0.997334  -17.2174     45.7791      11.2912      9.98067      14.4118    105.782      13.3524   -59.2934     
1 1 1 15 7  2  o 0 12.7482  0.857741  4.7602       -37.8707     10.2006      2.73593      49.3517    -98.1277     24.5738   -38.4252     
1 1 1 15 7  3  o 0 30.6622  0.651315  -14.4566     -1.53596     -4.69751     -1.47563     95.3317    132.811      38.5398   -95.6068     
1 1 1 15 7  4  o 0 26.0701  0.139649  -2.72549     -3.99577     2.3283       -3.91415     124.437    168.771      46.1891   159.796      
1 1 1 15 7  5  o 0 4.84994  1.47237   -11.3178     -19.3664     1.83862      -3.2097      24.2966    -108.994     15.7955   -76.4736     
1 1 1 15 7  6  o 0 17.134   0.629847  5.80188      0.476382     -1.54194     -0.151817    44.0654    25.3102      42.5224   -154.045     
1 1 1 15 7  7  o 0 21.8595  0.781222  -8.52663     5.36143      -1.03535     2.69759      96.3563    169.13       26.7478   173.43       
1 1 1 15 7  8  o 0 36.5288  0.547939  0.194068     11.9677      5.72106      0.598428     168.439    56.7936      57.4614   44.5049      
1 1 1 15 7  9  o 0 7.37121  0.97034   -5.28769     -2.50413     -1.06064     -1.12861     21.0006    -160.387     13.7353   -35.5258     
1 1 1 15 7  10 f 1 26.5323  0.609412  -0.336241    -4.09276     1.41558      -1.4839      94.1519    -7.98095     35.3319   -113.718     
1 1 1 15 7  11 o 0 18.8653  0.271697  0.275278     -0.13459     0            0            80.8028    169.911      22.5992   171.045      
1 1 1 15 8  0  o 0 4.1833   0.215683  -7.76727e-18 -0.042283    0            0            1.48002    90           3.91603   -90          
1 1 1 15 8  1  o 0 13.4933  0.605499  6.19475      0.554266     -1.51733     -0.228861    73.4448    6.5723       49.5693   6.88956      
1 1 1 15 8  2  o 0 21.9407  0.547639  -2.31093     -10.9062     4.18594      -2.30928     109.689    -161.777     51.1837   -142.21      
1 1 1 15 8  3  o 0 18.7766  1.00975   25.1475      -2.09511     -8.74905     1.84803      74.2878    -15.0158     7.97835   -31.9485     
1 1 1 15 8  4  o 0 19.7053  0.285675  -2.89035     6.67319      2.79972      3.58992      72.446     49.9876      9.61038   -156.736     
1 1 1 15 8  5  o 0 15.8482  0.355527  -6.07231     2.96347      -1.80167     1.9498       63.9221    -151.73      20.9854   140.627      
1 1 1 15 8  6  o 0 37.448   0.210511  -1.04904     0.0702655    -0.258154    -0.0166781   147.023    68.5973      5.02727   130.621      
1 1 1 15 8  7  o 0 12.383   1.03937   -6.44584     -0.91043     -1.74193     -0.222032    48.8063    -143.236     6.66048   178.867      
1 1 1 15 8  8  o 0 11.6541  0.461965  -0.00550492  -2.78012     1.55486      0.407247     54.9344    -29.8902     25.7947   -27.4581     
1 1 1 15 8  9  o 0 22.6483  0.546026  -4.41262     -0.426093    -3.08072     0.787914     93.3692    -105.75      23.9591   -155.08      
1 1 1 15 8  10 o 0 7.02139  0.260738  -0.235692    -0.0192472   0            0            21.8352    148.415      8.56316   162.357      
1 1 1 15 9  0  o 0 5.19615  0.158663  -4.28553e-19 -0.00233293  0            0            9.39574    -90          6.66476   90           
1 1 1 15 9  1  o 0 12.4848  0.537065  -4.56304     1.05548      -0.923421    0.493669     47.4118    150.957      7.58066   -128.52      
1 1 1 15 9  2  o 0 27.5322  0.152928  0.137823     -2.97201     6.49572      -2.95583     119.932    -15.9992     23.4874   -37.9712     
1 1 1 15 9  3  f 1 14.3273  0.811216  -14.2026     0.185816     -4.91028     0.333333     73.112     -139.554     36.138    -148.315     
1 1 1 15 9  4  o 0 21.7108  0.44269   -0.072522    -7.2643      5.48916      -0.734569    90.1975    -21.9542     12.0734   -52.027      
1 1 1 15 9  5  f 1 25.5266  0.381252  -0.40063     -0.489842    -0.437568    0.0014559    109.461    -119.265     20.7163   -111.717     
1 1 1 15 9  6  o 0 8.75234  0.156608  0.0824449    0.212741     -0.0186726   -0.155846    36.3342    129.414      15.3604   121.037      
1 1 1 15 9  7  o 0 5.88081  0.472937  -1.97223     -0.870896    -0.456983    -0.681419    16.2891    176.638      15.5067   -78.2865     
1 1 1 15 9  8  o 0 13.9078  1.75151   0.866323     16.2199      3.29768      -0.600607    32.7799    84.8376      41.5653   -119.003     
1 1 1 15 9  9  o 0 21.8472  0.306911  -0.0436753   0.720374     0            0            107.647    86.1187      51.603    86.552       
1 1 1 15 10 0  o 0 25.1893  0.255443  6.3959e-18   0.0208906    0            0            101.552    -90          10.9699   -90          
1 1 1 15 10 1  o 0 20.9521  0.173277  -1.19215     0.31392      -0.0991494   0.99521      90.5571    -128.786     18.0998   -156.84      
1 1 1 15 10 2  f 1 21.8066  0.431164  0.365051     -2.75668     0.693758     0.568585     102.773    -14.674      34.965    -22.9868     
1 1 1 15 10 3  o 0 7.72441  0.991344  8.05993      -0.898761    -2.27957     0.3341       21.8272    -12.3371     12.725    -167.358     
1 1 1 15 10 4  o 0 9.58672  0.817136  1.23096      3.66247      0.721217     -0.696075    25.6535    94.6915      20.7242   -70.1578     
1 1 1 15 10 5  o 0 16.9558  0.516152  -1.47258     -1.18621     -0.224818    -0.415045    64.6566    -150.474     2.01881   -46.558      
1 1 1 15 10 6  o 0 14.7032  0.533936  -2.97737     0.638663     -1.06891     0.0981806    46.1803    135.83       19.7981   -32.1845     
1 1 1 15 10 7  o 0 20.1911  0.170586  0.171345     0.677957     -0.827268    1.32683      66.6038    67.7393      22.3056   -96.8908     
1 1 1 15 11 0  o 0 21.8678  0.226293  5.82145e-17  0.190143     0            0            88.3943    90           24.9148   90           
1 1 1 15 11 1  o 0 18.1272  0.479798  0.535266     2.44441      0.583792     -0.650045    72.3761    131.708      6.91141   59.1936      
1 1 1 15 11 2  o 0 10.2294  0.137714  0.292224     0.850326     0.296675     -1.09656     35.1793    -12.257      12.7064   -128.38      
1 1 1 15 11 3  o 0 6.63349  0.526627  -1.9241      0.799855     -0.485698    0.36627      11.9208    170.389      35.6971   64.5694      
1 1 1 15 11 4  o 0 17.6498  0.212369  -0.232682    -0.900651    0.740174     0.456548     54.3216    3.65525      28.5818   -171.914     
1 1 1 16 0  0  f 1 9.47101  0.321494  -0.0422556   5.17481e-18  0            0            26.9763    0            10.8975   180          
1 1 1 16 0  1  o 0 47.5521  0.400382  -1.45443e-16 -0.791755    0            0            165.037    -90          20.3245   90           
1 1 1 16 0  2  o 0 13.1453  0.18379   -0.0165897   2.03165e-18  0            0            45.1748    0            14.1149   0            
1 1 1 16 0  3  o 0 43.3059  0.334542  7.63192e-17  0.249278     0            0            149.879    -90          6.01676   90           
1 1 1 16 0  4  o 0 34.887   0.282903  0.268331     0            0            0            120.479    180          16.8819   -180         
1 1 1 16 0  5  o 0 50.7957  0.325689  1.73833e-16  0.567781     0            0            174.929    -90          13.239    90           
1 1 1 16 0  6  o 0 45.1675  0.296929  0.418307     0            0            0            171.484    0            14.7685   0            
1 1 1 16 0  7  o 0 62.7391  0.454936  2.31661e-16  0.756663     0            0            237.194    90           0.586595  -90          
1 1 1 16 0  8  o 0 4.85798  0.235336  0.00180727   0            0            0            11.1479    180          12.551    -0           
1 1 1 16 0  9  o 0 15.7702  0.280321  -3.27049e-18 -0.0178037   0            0            58.9791    90           13.5396   90           
1 1 1 16 0  10 o 0 14.893   0.296206  -0.268756    3.29131e-17  0            0            55.3291    180          19.2787   -0           
1 1 1 16 1  0  o 0 77.1913  0.554996  -1.05061     1.28663e-16  0            0            269.016    180          32.0513   -180         
1 1 1 16 1  1  o 0 18.9472  0.16815   2.65253      -0.960965    -3.87635     4.23405      62.9193    57.0634      15.6681   -45.89       
1 1 1 16 1  2  o 0 28.1665  0.627616  -7.50854     16.1589      7.04121      7.41515      94.5485    177.193      26.7043   79.2935      
1 1 1 16 1  3  o 0 36.3302  0.656087  -4.61015     -10.0592     2.45015      -3.32917     130.937    -70.8298     11.763    -61.5521     
1 1 1 16 1  4  o 0 18.5937  1.65243   -17.6784     -68.4036     13.8117      -7.81974     98.9562    -95.3995     77.3012   -112.746     
1 1 1 16 1  5  o 0 8.624    0.97138   -40.7623     -11.5001     -12.3804     -7.46347     27.9424    -136.515     8.25851   136.083      
1 1 1 16 1  6  o 0 34.0722  0.776238  2.75129      -11.0781     11.7232      3.01876      132.997    -7.07682     20.0468   57.3792      
1 1 1 16 1  7  o 0 25.9788  0.168718  2.25761      -2.48022     -0.255223    1.86778      104.467    -115.24      17.5033   -84.1429     
1 1 1 16 1  8  o 0 27.2722  0.760426  5.46011      -2.08388     -0.72476     0.754278     113.115    -60.0745     26.0822   -36.5687     
1 1 1 16 1  9  o 0 12.166   0.407843  -4.60616     -3.60448     -0.528524    -2.98399     31.6012    -83.0289     27.3817   69.4392      
1 1 1 16 1  10 o 0 15.5285  1.17709   -1.50501     -5.84994     1.06439      -0.410414    59.1616    -90.9182     8.7237    -133.088     
1 1 1 16 2  0  o 0 12.5698  0.14937   0.065168     0            0            0            43.8533    0            3.59014   5.99971e-13  
1 1 1 16 2  1  o 0 33.7202  1.26968   54.1722      18.1043      -19.1325     -13.481      115.323    69.6782      8.29393   -46.8429     
1 1 1 16 2  2  o 0 18.9119  1.01381   -48.72       -3.99956     -16.7299     -2.47267     73.0245    144.255      16.8154   163.053      
1 1 1 16 2  3  o 0 26.1099  0.82295   -10.4222     22.3157      4.60779      5.18676      80.7939    140.481      17.8186   -40.3343     
1 1 1 16 2  4  o 0 44.3393  0.24019   -3.04372     1.42286      -2.49308     7.38038      158.327    -137.063     17.056    -85.0674     
1 1 1 16 2  5  o 0 32.7872  0.574304  35.0396      -2.708       -14.784      1.7956       122.871    -58.7384     49.2278   1.93584      
1 1 1 16 2  6  o 0 20.0568  0.536071  -1.37138     -8.36085     1.98738      -0.549504    78.1632    -57.7375     21.7332   -126.206     
1 1 1 16 2  7  o 0 23.2696  1.34135   16.9128      13.9761      -0.624812    -4.2302      92.8295    41.511       12.9538   21.0041      
1 1 1 16 2  8  o 0 14.4217  0.145498  -3.11934     0.385377     -4.57142     0.368704     56.7337    96.5747      9.59033   52.6851      
1 1 1 16 2  9  o 0 21.2553  0.798375  -3.21884     7.63992      1.23793      1.47738      81.307     144.827      9.34165   92.9009      
1 1 1 16 2  10 o 0 27.0612  1.88829   -7.73344     7.81515      -0.332472    1.61265      106.461    155.068      16.915    117.834      
1 1 1 16 2  11 o 0 7.42333  0.712053  -3.5157      0.0195764    -1.20719     -0.166415    24.5639    148.604      5.57217   -123.673     
1 1 1 16 3  0  o 0 27.4518  0.238343  0.255067     0            0            0            96.2729    0            5.84766   5.54905e-13  
1 1 1 16 3  1  o 0 23.9332  0.78594   -2.67441     18.9188      6.10923      1.63927      90.0955    115.733      17.9475   137.46       
1 1 1 16 3  2  o 0 16.0872  0.258629  -11.7135     6.51004      -6.3143      9.40942      55.2339    71.0328      23.6922   -14.8444     
1 1 1 16 3  3  o 0 25.3499  0.816237  5.36865      50.5365      29.1978      -7.12522     88.9108    146.691      6.03885   74.0942      
1 1 1 16 3  4  o 0 11.2462  0.88645   24.9219      28.0672      1.3191       -12.0707     49.2811    24.7306      27.4506   40.4992      
1 1 1 16 3  5  o 0 38.1568  0.205009  -2.75682     -3.55094     1.50298      -2.271       162.247    -31.9524     38.4067   -58.1118     
1 1 1 16 3  6  o 0 30.7426  0.188878  -0.931044    0.406633     1.62475      2.96491      132.753    44.027       35.5594   24.1251      
1 1 1 16 3  7  o 0 30.3575  0.931888  2.47883      -12.2959     4.28286      1.15925      147.857    -85.1188     69.6192   -83.1011     
1 1 1 16 3  8  f 1 24.3786  0.542629  8.85573      0.072843     -4.27791     -0.572209    87.7178    -54.1566     7.35876   152.095      
1 1 1 16 3  9  o 0 10.6815  0.349067  1.40754      6.35755      6.7249       -2.56132     23.9634    -9.62279     35.2695   -153.288     
1 1 1 16 3  10 o 0 9.85554  1.15571   -3.19034     -3.36806     -0.011521    -0.598958    49.5302    -149.511     34.326    -132.008     
1 1 1 16 3  11 o 0 19.6923  0.504884  0.781766     0.169807     -0.117085    -0.424317    69.3693    -66.4889     8.62281   52.4543      
1 1 1 16 4  0  o 0 43.876   0.323524  0.100287     0            0            0            154.346    0            12.3184   180          
1 1 1 16 4  1  f 1 28.5361  0.321783  6.62708      7.42814      0.920073     -4.99772     93.7131    -8.98218     11.4832   -173.551     
1 1 1 16 4  2  o 0 12.0469  1.04837   75.6691      -7.28096     -37.5273     7.67838      51.1713    45.1537      24.073    9.19652      
1 1 1 16 4  3  o 0 18.6164  1.07216   -3.28254     17.9437      3.82623      1.60802      55.5558    85.9688      17.6486   -120.037     
1 1 1 16 4  4  o 0 28.6863  0.313124  -10.919      0.871433     -8.44003     0.418294     126.038    106.583      34.124    122.143      
1 1 1 16 4  5  o 0 18.9706  0.122883  0.338651     0.0973033    -0.74414     0.404813     85.7676    -117.832     31.958    -103.847     
1 1 1 16 4  6  o 0 21.4852  0.311608  -0.835105    0.228582     -0.2299      0.166479     91.2255    -179.409     22.7874   -178.111     
1 1 1 16 4  7  f 1 38.4841  0.518162  0.528345     -7.46355     2.15991      0.651809     156.357    -39.8972     22.3864   -50.7639     
1 1 1 16 4  8  o 0 35.6548  1.41678   26.8149      -2.1975      -6.89195     0.633374     142.583    -24.8336     16.945    -27.5747     
1 1 1 16 4  9  o 0 8.09823  0.639793  -1.2696      3.66321      1.26296      0.735836     30.5994    120.812      10.9244   135.261      
1 1 1 16 4  10 f 1 20.8767  0.87967   -7.81454     -0.767829    -2.02678     0.10198      89.4031    -133.248     26.9544   -150.781     
1 1 1 16 4  11 o 0 13.8014  0.266262  0.314814     0.203977     -0.0350849   -0.0218626   51.2927    -24.8849     5.36466   -3.18211     
1 1 1 16 5  0  o 0 43.5569  0.328121  -0.110222    1.34983e-17  0            0            170.035    0            38.0071   1.34647e-13  
1 1 1 16 5  1  o 0 27.7201  0.448058  -4.05915     -8.60684     2.85156      -4.2637      91.9824    -58.3646     31.2348   103.901      
1 1 1 16 5  2  o 0 31.4095  0.840691  -9.88109     -3.78481     -1.69149     -1.2876      137.483    -140.89      33.9363   -146.075     
1 1 1 16 5  3  o 0 29.2693  1.99486   -1.47137     -63.5497     16.1683      -1.33951     138.771    -68.5571     54.2647   -79.0279     
1 1 1 16 5  4  f 1 46.8971  0.304398  2.07207      -0.355645    -0.998309    -0.19476     193.029    64.0448      25.8429   62.282       
1 1 1 16 5  5  o 0 18.785   0.126014  0.58585      -0.309111    1.28837      2.51877      47.3285    28.5545      51.8849   179.249      
1 1 1 16 5  6  o 0 28.1068  0.452381  1.15754      2.5639       0.723552     -1.7601      125.192    95.9214      40.5449   111.384      
1 1 1 16 5  7  o 0 17.8209  1.33334   -7.92485     -29.514      6.0549       -3.23854     62.9018    -109.206     7.36433   77.3389      
1 1 1 16 5  8  o 0 17.5965  0.461378  -2.83342     -0.599486    -1.05635     -1.05479     51.1499    -128.888     28.2309   42.6073      
1 1 1 16 5  9  o 0 16.4957  0.912295  -0.0225182   -6.30828     2.5679       0.512688     56.1979    -30.1592     13.7646   -160.01      
1 1 1 16 5  10 o 0 14.091   1.17957   4.04144      -2.241       -0.264159    0.542136     29.2458    -19.9278     44.3847   168.003      
1 1 1 16 6  0  o 0 7.54321  0.149464  -0.0681023   8.34012e-18  0            0            25.4445    -180         2.06448   8.49035e-13  
1 1 1 16 6  1  f 1 26.098   0.143993  -0.823444    -0.156368    -1.78755     1.57681      119.13     -128.542     40.714    -107.82      
1 1 1 16 6  2  o 0 34.2433  0.850883  18.5892      -5.61287     -9.43342     4.79053      150.28     -73.0506     39.6072   -97.0674     
1 1 1 16 6  3  o 0 22.1046  0.149613  -0.1495      0.805138     0.758699     -0.0548623   96.7905    -7.05973     27.305    8.73952      
1 1 1 16 6  4  o 0 23.9208  1.24791   -23.1639     -7.61853     -5.35811     -3.61272     99.9703    -164.805     19.258    -154.986     
1 1 1 16 6  5  o 0 34.2728  0.5608    5.00696      0.433557     -1.76105     -0.102866    138.629    -29.4355     15.2215   -32.1749     
1 1 1 16 6  6  o 0 18.4839  0.141533  -0.289558    0.939933     1.11274      1.90438      70.5561    37.5431      2.71631   -8.37186     
1 1 1 16 6  7  o 0 15.7255  0.422599  -2.61242     1.95122      -1.15486     1.56778      52.0219    80.9762      19.2849   -148.596     
1 1 1 16 6  8  o 0 13.517   0.178799  0.548835     0.433689     -2.16826     0.746575     56.9779    -97.9297     15.4185   -79.6488     
1 1 1 16 6  9  f 1 20.1535  0.211319  0.436299     0.426407     0.64896      0.00969712   73.4631    18.5627      3.60766   -104.686     
1 1 1 16 6  10 o 0 14.3562  0.266661  -0.145384    0.395676     0            0            59.6803    -167.569     17.6842   -176.984     
1 1 1 16 7  0  o 0 12.1573  0.158322  -0.0869808   1.06521e-17  0            0            47.724     0            9.03001   180          
1 1 1 16 7  1  f 1 11.2391  0.10726   -1.33906     -1.05914     0.0791464    -4.6518      56.9175    140.771      28.0177   139.152      
1 1 1 16 7  2  o 0 6.02717  0.307095  0.445051     3.68023      2.24243      -0.691017    22.9194    125.813      19.2897   55.4234      
1 1 1 16 7  3  o 0 45.4384  0.257722  -1.28474     -5.4034      4.45319      -0.43865     191.79     -171.941     31.9995   -162.421     
1 1 1 16 7  4  o 0 29.1899  0.615925  0.527991     -4.04398     1.50217      0.161964     123.345    -57.5743     23.1658   -50.2609     
1 1 1 16 7  5  o 0 18.0995  0.937374  -3.65853     0.735726     -0.657764    0.491075     74.4066    166.615      13.2235   177.332      
1 1 1 16 7  6  o 0 48.6988  2.00306   1.21209      -13.6845     2.89166      -0.70564     203.045    -47.4799     34.5219   -57.736      
1 1 1 16 7  7  o 0 31.1438  0.307371  1.99375      1.04929      0.205337     -1.06694     124.749    -4.81191     14.3368   -16.5768     
1 1 1 16 7  8  o 0 24.226   0.345889  0.121284     -0.369768    0            0            88.7991    -82.6236     3.50479   91.4084      
1 1 1 16 7  9  o 0 23.0478  0.32724   0.481212     0.0796295    0            0            97.5654    80.7897      24.9378   76.0671      
1 1 1 16 8  0  f 1 10.373   0.161357  0.139893     0            0            0            40.8451    0            4.06895   180          
1 1 1 16 8  1  o 0 20.6555  1.51054   -12.1008     0.0633992    -2.58019     -0.372761    88.1182    -171.585     18.3889   168.299      
1 1 1 16 8  2  o 0 30.6799  0.66131   2.36149      -0.901042    -0.273157    0.603869     128.505    7.42497      19.1342   8.26642      
1 1 1 16 8  3  o 0 9.58832  0.126429  -0.121091    -0.0144357   0.0224795    0.0663511    19.1409    131.425      31.547    -53.4763     
1 1 1 16 8  4  o 0 15.6661  0.320941  0.279616     0.650451     -0.0709315   -0.40255     58.7331    64.4004      4.39877   151.403      
1 1 1 16 8  5  o 0 15.3123  1.32189   -9.56971     0.655008     -2.65573     0.670217     59.5883    -146.178     12.1154   145.024      
1 1 1 16 8  6  o 0 4.70353  0.51079   0.749454     -2.11074     0.525682     0.5181       2.40992    -65.9054     24.6247   91.9473      
1 1 1 16 8  7  o 0 15.2348  0.251796  -0.222623    -0.633433    0            0            64.7021    -128.806     18.0279   -123.857     
1 1 1 16 9  0  o 0 21.4895  0.325428  0.42313      0            0            0            84.9448    0            19.7858   180          
1 1 1 16 9  1  o 0 12.6796  0.619592  2.13926      0.465588     -0.316735    -0.23481     49.5828    48.6649      8.56969   -10.1122     
1 1 1 16 9  2  o 0 10.04    0.535133  -0.651511    2.65165      0.766705     0.63241      43.4768    130.685      17.5489   121.372      
1 1 1 16 9  3  o 0 20.9492  0.187847  0.0166098    -0.163139    -0.000929045 0.0111613    77.8167    -130.895     4.99676   40.9478      
1 1 1 16 9  4  o 0 10.3553  0.367854  -1.2341      -1.88796     0.800169     -0.984593    39.619     -179.847     6.25395   -118.563     
1 1 1 16 9  5  o 0 8.49981  0.271449  0.440908     0.429746     -0.277104    -0.397247    32.7681    -63.3961     13.287    -17.3463     
1 1 1 16 10 0  o 0 13.7368  0.264218  -0.0852593   1.04413e-17  0            0            54.4477    0            14.6001   6.52742e-15  
1 1 1 16 10 1  o 0 11.3723  0.209256  -0.925472    -0.616663    -1.6414      -0.763637    48.5984    -84.2252     14.7142   -124.368     
1 1 1 17 0  1  o 0 25.3219  0.252196  8.92879e-17  0.291637     0            0            94.9478    -90          22.1578   -90          
1 1 1 17 0  2  o 0 27.6369  0.305963  0.0506915    0            0            0            103.432    0            12.0304   180          
1 1 1 17 0  3  o 0 26.1992  0.326079  1.82419e-16  0.595827     0            0            97.821     -90          2.32892   90           
1 1 1 17 0  4  o 0 50.1418  0.537662  0.343639     0            0            0            186.678    0            3.48183   180          
1 1 1 17 0  6  o 0 50.1009  0.632667  -0.347805    4.25938e-17  0            0            185.115    180          19.4385   -180         
1 1 1 17 1  0  o 0 24.1971  0.24141   -2.13808e-17 -0.116392    0            0            91.2434    -90          11.1334   -90          
1 1 1 17 1  1  o 0 26.8642  0.185815  1.10321      1.00683      1.33767      -2.13903     113.361    -30.7678     30.2242   -6.27635     
1 1 1 17 1  2  f 1 13.6564  0.167718  0.49632      -2.9258      18.8269      -0.884786    28.7499    -9.68398     45.3566   -174.874     
1 1 1 17 1  3  o 0 25.4895  0.271611  -0.785974    0.0399144    -0.575326    0.345968     101.623    -117.55      15.4995   -122.148     
1 1 1 17 1  4  o 0 31.4667  1.49268   -5.51044     34.3388      7.33698      2.81736      98.4178    122.41       44.1367   -19.8893     
1 1 1 17 1  5  o 0 18.3291  0.431767  -1.6669      -5.4698      1.58534      -0.876135    69.8781    -155.905     10.0535   -103.884     
1 1 1 17 1  6  o 0 11.6074  0.427864  -1.63254     -3.82744     0.950416     -0.883381    25.6228    -152.195     33.2593   6.59832      
1 1 1 17 1  7  f 1 18.6035  0.833653  1.96609      2.13611      -0.129535    -0.823203    69.9301    42.9115      6.36988   61.8921      
1 1 1 17 2  0  o 0 21.9066  0.203518  -5.25181e-17 -0.285895    0            0            82.9291    90           26.498    90           
1 1 1 17 2  1  o 0 20.4555  0.625309  -8.93374     2.8016       -3.88549     3.19019      68.8885    -141.299     24.8738   -20.5557     
1 1 1 17 2  2  o 0 24.181   0.924913  -9.02244     1.79933      -1.76844     0.886296     97.9858    178.227      17.181    176.998      
1 1 1 17 2  3  o 0 9.44643  1.3258    -36.3362     -1.99565     -12.4613     -1.17099     47.3028    -151.611     35.4959   173.532      
1 1 1 17 2  4  o 0 19.4495  0.407999  3.44186      0.929655     -3.04772     -1.0804      83.708     87.7469      30.6439   53.7509      
1 1 1 17 2  5  f 1 6.05747  0.897401  -3.02542     -6.22137     0.93062      -1.25414     15.6154    -113.095     9.56457   47.8228      
1 1 1 17 2  6  o 0 8.24073  0.684965  -5.22969     1.87253      -2.25839     1.37429      36.5739    120.571      21.6533   112.695      
1 1 1 17 2  7  f 1 11.0525  1.26288   7.40218      -1.16361     -1.73701     0.783288     46.1454    -21.3896     17.7918   -0.124013    
1 1 1 17 3  0  o 0 13.2665  0.163796  3.85656e-17  0.125965     0            0            50.3768    90           2.43848   90           
1 1 1 17 3  1  f 1 34.6547  1.86343   -0.590489    -49.5227     10.7682      0.232107     165.06     -105.904     70.2735   -100.01      
1 1 1 17 3  2  o 0 17.7574  0.70225   0.210729     9.45425      5.12503      -0.634818    76.09      44.2202      33.783    6.67615      
1 1 1 17 3  3  o 0 38.6749  0.300674  0.26767      -0.126984    0.181417     -0.161735    148.98     12.1892      8.88529   -4.35697     
1 1 1 17 3  4  o 0 27.1654  0.872059  -5.12331     5.52766      0.46351      2.36236      108.527    104.177      15.2532   104.5        
1 1 1 17 3  5  o 0 14.6305  1.53188   -3.13066     -37.02       10.7929      -2.0992      43.7455    -66.8111     19.7671   114.323      
1 1 1 17 3  6  o 0 12.0096  0.81025   -1.92136     -1.94502     -0.0586558   -0.565096    54.921     -124.079     27.1721   -125.424     
1 1 1 17 3  7  o 0 20.2377  0.726781  0.00371192   -4.48953     1.91617      -0.701186    60.5878    -61.6012     28.7281   92.7357      
1 1 1 17 3  8  o 0 5.11121  0.799742  -0.0973649   -2.85164     0.612172     -0.0882137   12.6715    -83.5588     15.8193   13.0315      
1 1 1 17 4  0  o 0 29.8479  0.308377  1.71967e-16  0.561686     0            0            113.83     90           4.65545   -90          
1 1 1 17 4  1  o 0 21.5247  0.401313  1.18394      -0.92502     -0.0393827   0.723247     102.139    6.13045      44.2205   7.81518      
1 1 1 17 4  2  o 0 24.0252  1.02131   -16.4047     -5.10036     -2.98013     -2.29772     111.712    179.108      44.1318   -176.311     
1 1 1 17 4  3  o 0 9.8466   0.435167  1.75606      0.493837     -0.43919     -0.23709     24.0099    34.2342      21.7164   -143.235     
1 1 1 17 4  4  o 0 19.5186  0.851733  20.1147      -5.80777     -6.01451     3.41295      88.7848    -33.8462     35.9239   -44.7375     
1 1 1 17 4  5  o 0 33.7437  0.321629  -0.899982    -0.45296     0.553441     0.308362     110.256    -82.0572     31.3041   106.619      
1 1 1 17 4  6  o 0 8.60502  1.62558   -18.2722     -0.18677     -5.43449     0.201456     32.6276    167.811      22.2744   -124.401     
1 1 1 17 4  7  o 0 10.5948  0.383882  0.343873     -0.624671    0.0468054    0.175811     40.2752    -135.591     10.7793   -97.03       
1 1 1 17 4  8  o 0 12.3356  0.238498  0.492483     -0.0827362   -0.196538    -0.0168153   32.6753    -122.824     23.1796   32.7096      
1 1 1 17 5  0  o 0 8.11788  0.198349  -7.20417e-18 -0.0392177   0            0            30.6935    -90          6.08352   90           
1 1 1 17 5  1  o 0 23.4418  1.41429   9.13639      -36.6979     11.1181      5.30856      59.6314    -39.7059     59.6316   124.359      
1 1 1 17 5  2  o 0 17.675   0.412093  -0.299231    -0.521275    0.0970233    -0.0397382   81.1959    -87.3702     32.6108   -89.5992     
1 1 1 17 5  3  o 0 17.7617  0.649162  -2.37101     -0.928878    -0.291534    -0.465536    55.7951    -143.383     20.35     45.6639      
1 1 1 17 5  4  o 0 7.44034  0.485532  0.69174      1.13291      0.1344       -0.441083    19.3243    4.75595      18.8074   123.996      
1 1 1 17 5  5  o 0 14.8974  0.602884  -1.40239     -7.21299     4.35049      -0.769041    45.7316    -161.446     25.6524   68.0303      
1 1 1 17 5  6  o 0 14.9234  0.19532   -0.31639     -0.0875029   -0.0770545   -0.148502    65.8996    -66.2406     25.5395   -69.8688     
1 1 1 17 5  7  o 0 7.22708  0.763008  0.190956     -5.16886     1.98956      0.359343     11.4563    -59.0826     26.7398   139.621      
1 1 1 17 5  8  o 0 24.9164  0.335824  0.564527     -0.662862    0.398509     0.134335     93.5298    -10.0231     5.33383   -12.4657     
1 1 1 17 6  0  f 1 26.2774  0.267458  -1.20305e-16 -0.654911    0            0            100.933    -90          2.2514    -90          
1 1 1 17 6  1  o 0 31.1435  0.213913  0.545209     0.150081     -0.188986    0.126468     118.281    37.5364      0.801105  126.146      
1 1 1 17 6  2  o 0 14.3507  0.448511  -1.55993     -1.46058     -0.364069    -0.949122    45.3979    171.227      15.1914   -2.46768     
1 1 1 17 6  3  o 0 26.974   0.289405  0.312204     0.826574     -1.40985     0.196344     116.152    -93.9967     29.703    -91.9223     
1 1 1 17 6  4  o 0 25.8767  0.695062  -4.28612     3.61067      -0.995178    1.65734      109.286    113.376      25.775    103.076      
1 1 1 17 6  5  o 0 11.6326  0.185946  -1.08103     0.60692      -0.551078    0.363499     31.8601    170.014      18.9638   -4.8315      
1 1 1 17 6  6  o 0 13.9744  0.988517  -9.37384     -0.0889979   -2.84939     -0.432139    44.518     145.712      13.184    -48.4844     
1 1 1 17 6  7  o 0 34.2249  1.0757    -2.94189     -1.36661     -0.531149    -0.203368    120.251    -105.785     13.865    99.3093      
1 1 1 17 7  0  o 0 25.9538  0.263175  -2.7874e-17  -0.151739    0            0            100.043    -90          4.74331   90           
1 1 1 17 7  1  o 0 9.40288  0.771334  -2.03703     4.10014      1.06805      1.07061      20.8458    139.533      26.3413   -55.0424     
1 1 1 17 7  2  o 0 38.71    1.05601   0.568958     -5.96949     1.77526      -0.599225    145.923    -64.9544     5.32102   55.9619      
1 1 1 17 7  3  f 1 17.2919  0.651183  2.1909       0.67906      -0.282178    -0.297313    62.8565    40.0771      4.31535   -86.9433     
1 1 1 17 7  4  o 0 5.19037  0.335185  0.188255     -1.72048     1.78004      0.0414163    3.55134    -140.135     15.4056   78.0417      
1 1 1 17 7  5  o 0 18.4444  0.646783  0.149217     -2.4198      1.19087      -0.386534    73.9257    -22.0706     14.7382   -58.3206     
1 1 1 17 8  0  o 0 3.09839  0.333322  8.76009e-18  0.0286126    0            0            0.550609   -90          2.34281   90           
1 1 1 17 8  1  f 1 5.19945  0.2491    -1.02203     0.453103     -0.476213    0.798801     15.634     -161.094     17.1366   120.831      
1 1 1 17 8  2  o 0 11.2557  0.367633  -0.269919    -0.453381    0.0485108    -0.073626    51.45      150.657      26.0124   160.281      
1 1 1 0  16 8  x 0 ?        ?         1e-30        0            0            0            43.0859    180          ?         ?            
1 1 1 9  11 16 x 0 ?        ?         1e-30        0            0            0            9.7432     90.061       ?         ?            
1 1 1 17 0  5  x 0 ?        ?         1e-30        0            0            0            23.3984    90           ?         ?            
1 1 1 0  0  24 x 0 ?        ?         ?            ?            ?            ?            17.0226    0            ?         ?            
1 1 1 0  1  24 x 0 ?        ?         ?            ?            ?            ?            9.77858    -90          ?         ?            
1 1 1 0  10 20 x 0 ?        ?         ?            ?            ?            ?            75.9124    0            ?         ?            
1 1 1 0  11 19 x 0 ?        ?         ?            ?            ?            ?            22.7149    90           ?         ?            
1 1 1 0  12 18 x 0 ?        ?         ?            ?            ?            ?            52.9802    180          ?         ?            
1 1 1 0  16 7  x 0 ?        ?         ?            ?            ?            ?            224.948    180          ?         ?            
1 1 1 0  18 0  x 0 ?        ?         ?            ?            ?            ?            49.5331    4.79211e-14  ?         ?            
1 1 1 0  18 1  x 0 ?        ?         ?            ?            ?            ?            9.75802    0            ?         ?            
1 1 1 0  18 2  x 0 ?        ?         ?            ?            ?            ?            152.933    180          ?         ?            
1 1 1 0  18 3  x 0 ?        ?         ?            ?            ?            ?            22.1719    0            ?         ?            
1 1 1 0  18 4  x 0 ?        ?         ?            ?            ?            ?            144.489    0            ?         ?            
1 1 1 0  18 5  x 0 ?        ?         ?            ?            ?            ?            86.8709    180          ?         ?            
1 1 1 0  18 6  x 0 ?        ?         ?            ?            ?            ?            25.8742    0            ?         ?            
1 1 1 0  18 7  x 0 ?        ?         ?            ?            ?            ?            108.923    180          ?         ?            
1 1 1 0  18 8  x 0 ?        ?         ?            ?            ?            ?            124.256    180          ?         ?            
1 1 1 0  19 1  x 0 ?        ?         ?            ?            ?            ?            47.5564    -90          ?         ?            
1 1 1 0  19 2  x 0 ?        ?         ?            ?            ?            ?            10.2887    -90          ?         ?            
1 1 1 0  19 3  x 0 ?        ?         ?            ?            ?            ?            106.73     -90          ?         ?            
1 1 1 1  0  24 x 0 ?        ?         ?            ?            ?            ?            31.6086    180          ?         ?            
1 1 1 1  10 20 x 0 ?        ?         ?            ?            ?            ?            35.766     37.0451      ?         ?            
1 1 1 1  11 19 x 0 ?        ?         ?            ?            ?            ?            143.587    -63.9391     ?         ?            
1 1 1 1  12 18 x 0 ?        ?         ?            ?            ?            ?            44.5225    154.589      ?         ?            
1 1 1 1  18 0  x 0 ?        ?         ?            ?            ?            ?            14.1198    90           ?         ?            
1 1 1 1  18 1  x 0 ?        ?         ?            ?            ?            ?            93.7812    -133.468     ?         ?            
1 1 1 1  18 2  x 0 ?        ?         ?            ?            ?            ?            28.0119    60.6814      ?         ?            
1 1 1 1  18 3  x 0 ?        ?         ?            ?            ?            ?            181.35     115.497      ?         ?            
1 1 1 1  18 4  x 0 ?        ?         ?            ?            ?            ?            26.5301    47.6755      ?         ?            
1 1 1 1  18 5  x 0 ?        ?         ?            ?            ?            ?            29.3983    -30.4333     ?         ?            
1 1 1 1  18 6  x 0 ?        ?         ?            ?            ?            ?            54.9326    -122.057     ?         ?            
1 1 1 1  18 7  x 0 ?        ?         ?            ?            ?            ?            76.8264    -22.7463     ?         ?            
1 1 1 1  18 8  x 0 ?        ?         ?            ?            ?            ?            53.5272    79.478       ?         ?            
1 1 1 1  19 0  x 0 ?        ?         ?            ?            ?            ?            38.964     90           ?         ?            
1 1 1 1  19 1  x 0 ?        ?         ?            ?            ?            ?            107.043    -53.2144     ?         ?            
1 1 1 1  19 2  x 0 ?        ?         ?            ?            ?            ?            20.9954    80.8734      ?         ?            
1 1 1 1  19 3  x 0 ?        ?         ?            ?            ?            ?            75.8566    -10.4202     ?         ?            
1 1 1 2  10 20 x 0 ?        ?         ?            ?            ?            ?            102.289    163.502      ?         ?            
1 1 1 2  11 19 x 0 ?        ?         ?            ?            ?            ?            56.4232    98.9301      ?         ?            
1 1 1 2  12 18 x 0 ?        ?         ?            ?            ?            ?            18.2326    -107.049     ?         ?            
1 1 1 2  18 0  x 0 ?        ?         ?            ?            ?            ?            117.717    -3.37281e-15 ?         ?            
1 1 1 2  18 1  x 0 ?        ?         ?            ?            ?            ?            45.479     136.164      ?         ?            
1 1 1 2  18 2  x 0 ?        ?         ?            ?            ?            ?            47.9522    146.82       ?         ?            
1 1 1 2  18 3  x 0 ?        ?         ?            ?            ?            ?            23.8042    -116.378     ?         ?            
1 1 1 2  18 4  x 0 ?        ?         ?            ?            ?            ?            32.5314    -85.5863     ?         ?            
1 1 1 2  18 5  x 0 ?        ?         ?            ?            ?            ?            29.3196    -35.1061     ?         ?            
1 1 1 2  18 6  x 0 ?        ?         ?            ?            ?            ?            52.9265    154.257      ?         ?            
1 1 1 2  18 7  x 0 ?        ?         ?            ?            ?            ?            35.4876    136.565      ?         ?            
1 1 1 2  18 8  x 0 ?        ?         ?            ?            ?            ?            60.4174    -138.205     ?         ?            
1 1 1 2  19 0  x 0 ?        ?         ?            ?            ?            ?            105.894    3.67705e-14  ?         ?            
1 1 1 2  19 1  x 0 ?        ?         ?            ?            ?            ?            55.9117    151.244      ?         ?            
1 1 1 2  19 2  x 0 ?        ?         ?            ?            ?            ?            7.10144    134.748      ?         ?            
1 1 1 3  0  23 x 0 ?        ?         ?            ?            ?            ?            33.2509    90           ?         ?            
1 1 1 3  10 20 x 0 ?        ?         ?            ?            ?            ?            88.3767    61.4989      ?         ?            
1 1 1 3  11 19 x 0 ?        ?         ?            ?            ?            ?            29.0642    -28.2051     ?         ?            
1 1 1 3  12 18 x 0 ?        ?         ?            ?            ?            ?            48.502     64.2832      ?         ?            
1 1 1 3  13 17 x 0 ?        ?         ?            ?            ?            ?            63.55      -20.3554     ?         ?            
1 1 1 3  18 0  x 0 ?        ?         ?            ?            ?            ?            110.918    -90          ?         ?            
1 1 1 3  18 1  x 0 ?        ?         ?            ?            ?            ?            47.1307    -121.455     ?         ?            
1 1 1 3  18 2  x 0 ?        ?         ?            ?            ?            ?            62.0204    171.538      ?         ?            
1 1 1 3  18 3  x 0 ?        ?         ?            ?            ?            ?            91.3175    -37.1106     ?         ?            
1 1 1 3  18 4  x 0 ?        ?         ?            ?            ?            ?            33.1314    41.2004      ?         ?            
1 1 1 3  18 5  x 0 ?        ?         ?            ?            ?            ?            67.0298    73.5509      ?         ?            
1 1 1 3  18 6  x 0 ?        ?         ?            ?            ?            ?            99.5117    -34.0683     ?         ?            
1 1 1 3  18 7  x 0 ?        ?         ?            ?            ?            ?            92.0147    111.49       ?         ?            
1 1 1 4  0  23 x 0 ?        ?         ?            ?            ?            ?            3.12603    -90          ?         ?            
1 1 1 4  11 19 x 0 ?        ?         ?            ?            ?            ?            26.6888    -163.925     ?         ?            
1 1 1 4  12 18 x 0 ?        ?         ?            ?            ?            ?            56.9565    117.559      ?         ?            
1 1 1 4  18 0  x 0 ?        ?         ?            ?            ?            ?            77.3303    -7.78481e-15 ?         ?            
1 1 1 4  18 1  x 0 ?        ?         ?            ?            ?            ?            37.8913    92.4595      ?         ?            
1 1 1 4  18 2  x 0 ?        ?         ?            ?            ?            ?            69.7649    25.3721      ?         ?            
1 1 1 4  18 3  x 0 ?        ?         ?            ?            ?            ?            72.3772    13.0718      ?         ?            
1 1 1 4  18 4  x 0 ?        ?         ?            ?            ?            ?            6.37454    28.7071      ?         ?            
1 1 1 4  18 5  x 0 ?        ?         ?            ?            ?            ?            69.8876    25.6566      ?         ?            
1 1 1 4  18 6  x 0 ?        ?         ?            ?            ?            ?            44.0869    -120.446     ?         ?            
1 1 1 5  0  22 x 0 ?        ?         ?            ?            ?            ?            60.8743    3.28034e-15  ?         ?            
1 1 1 5  0  23 x 0 ?        ?         ?            ?            ?            ?            29.1509    -90          ?         ?            
1 1 1 5  1  23 x 0 ?        ?         ?            ?            ?            ?            47.8296    -69.6994     ?         ?            
1 1 1 5  11 17 x 0 ?        ?         ?            ?            ?            ?            42.8892    31.9914      ?         ?            
1 1 1 5  11 18 x 0 ?        ?         ?            ?            ?            ?            57.9247    -7.85679     ?         ?            
1 1 1 5  12 17 x 0 ?        ?         ?            ?            ?            ?            44.8116    -166.269     ?         ?            
1 1 1 5  18 0  x 0 ?        ?         ?            ?            ?            ?            90.1932    90           ?         ?            
1 1 1 5  18 1  x 0 ?        ?         ?            ?            ?            ?            29.9772    -21.3121     ?         ?            
1 1 1 5  18 2  x 0 ?        ?         ?            ?            ?            ?            65.706     4.07779      ?         ?            
1 1 1 5  18 3  x 0 ?        ?         ?            ?            ?            ?            62.5597    141.375      ?         ?            
1 1 1 5  18 4  x 0 ?        ?         ?            ?            ?            ?            88.0742    47.6172      ?         ?            
1 1 1 5  18 5  x 0 ?        ?         ?            ?            ?            ?            55.9699    162.245      ?         ?            
1 1 1 6  11 18 x 0 ?        ?         ?            ?            ?            ?            67.9251    45.0518      ?         ?            
1 1 1 6  12 17 x 0 ?        ?         ?            ?            ?            ?            130.466    -64.7925     ?         ?            
1 1 1 6  18 0  x 0 ?        ?         ?            ?            ?            ?            98.5438    -180         ?         ?            
1 1 1 6  18 1  x 0 ?        ?         ?            ?            ?            ?            66.7437    98.4509      ?         ?            
1 1 1 6  18 2  x 0 ?        ?         ?            ?            ?            ?            34.7333    -159.65      ?         ?            
1 1 1 6  18 3  x 0 ?        ?         ?            ?            ?            ?            97.9173    -176.333     ?         ?            
1 1 1 7  0  22 x 0 ?        ?         ?            ?            ?            ?            30.6004    180          ?         ?            
1 1 1 7  1  22 x 0 ?        ?         ?            ?            ?            ?            30.3093    160.073      ?         ?            
1 1 1 8  17 0  x 0 ?        ?         ?            ?            ?            ?            28.488     1.42718e-14  ?         ?            
1 1 1 9  0  21 x 0 ?        ?         ?            ?            ?            ?            24.7975    90           ?         ?            
1 1 1 9  1  21 x 0 ?        ?         ?            ?            ?            ?            96.8504    137.294      ?         ?            
1 1 1 10 0  20 x 0 ?        ?         ?            ?            ?            ?            19.2682    0            ?         ?            
1 1 1 10 1  20 x 0 ?        ?         ?            ?            ?            ?            62.1325    -142.821     ?         ?            
1 1 1 11 0  19 x 0 ?        ?         ?            ?            ?            ?            32.0308    90           ?         ?            
1 1 1 11 1  19 x 0 ?        ?         ?            ?            ?            ?            59.9934    -165.103     ?         ?            
1 1 1 12 0  18 x 0 ?        ?         ?            ?            ?            ?            29.3885    0            ?         ?            
1 1 1 12 1  18 x 0 ?        ?         ?            ?            ?            ?            47.6834    -112.101     ?         ?            
1 1 1 13 0  17 x 0 ?        ?         ?            ?            ?            ?            28.0373    -90          ?         ?            
1 1 1 13 1  17 x 0 ?        ?         ?            ?            ?            ?            96.7583    151.7        ?         ?            
1 1 1 14 0  15 x 0 ?        ?         ?            ?            ?            ?            14.304     -90          ?         ?            
1 1 1 14 0  16 x 0 ?        ?         ?            ?            ?            ?            95.5962    0            ?         ?            
1 1 1 14 1  16 x 0 ?        ?         ?            ?            ?            ?            49.0756    164.004      ?         ?            
1 1 1 15 0  13 x 0 ?        ?         ?            ?            ?            ?            37.6211    90           ?         ?            
1 1 1 15 0  14 x 0 ?        ?         ?            ?            ?            ?            58.6716    0            ?         ?            
1 1 1 15 1  14 x 0 ?        ?         ?            ?            ?            ?            48.0187    -85.908      ?         ?            
1 1 1 15 2  14 x 0 ?        ?         ?            ?            ?            ?            75.3367    141.488      ?         ?            
1 1 1 16 0  11 x 0 ?        ?         ?            ?            ?            ?            29.2931    90           ?         ?            
1 1 1 16 0  12 x 0 ?        ?         ?            ?            ?            ?            46.772     180          ?         ?            
1 1 1 16 1  11 x 0 ?        ?         ?            ?            ?            ?            54.6585    66.3678      ?         ?            
1 1 1 16 1  12 x 0 ?        ?         ?            ?            ?            ?            53.3774    97.7109      ?         ?            
1 1 1 16 2  12 x 0 ?        ?         ?            ?            ?            ?            99.5295    -74.8006     ?         ?            
1 1 1 16 3  12 x 0 ?        ?         ?            ?            ?            ?            98.6972    138.186      ?         ?            
1 1 1 17 0  7  x 0 ?        ?         ?            ?            ?            ?            34.566     -90          ?         ?            
1 1 1 17 0  8  x 0 ?        ?         ?            ?            ?            ?            30.4723    180          ?         ?            
1 1 1 17 0  9  x 0 ?        ?         ?            ?            ?            ?            50.9924    90           ?         ?            
1 1 1 17 0  10 x 0 ?        ?         ?            ?            ?            ?            66.0289    180          ?         ?            
1 1 1 17 1  8  x 0 ?        ?         ?            ?            ?            ?            88.3745    46.1633      ?         ?            
1 1 1 17 1  9  x 0 ?        ?         ?            ?            ?            ?            64.5565    65.0671      ?         ?            
1 1 1 17 1  10 x 0 ?        ?         ?            ?            ?            ?            67.5687    114.767      ?         ?            
1 1 1 17 2  8  x 0 ?        ?         ?            ?            ?            ?            80.9886    -17.3921     ?         ?            
1 1 1 17 2  9  x 0 ?        ?         ?            ?            ?            ?            67.3173    -150.594     ?         ?            
1 1 1 17 3  9  x 0 ?        ?         ?            ?            ?            ?            98.7488    -77.8327     ?         ?            
1 1 1 18 0  0  x 0 ?        ?         ?            ?            ?            ?            20.0207    -4.00012e-14 ?         ?            
1 1 1 18 0  1  x 0 ?        ?         ?            ?            ?            ?            4.38022    -90          ?         ?            
1 1 1 18 0  2  x 0 ?        ?         ?            ?            ?            ?            69.286     180          ?         ?            
1 1 1 18 0  3  x 0 ?        ?         ?            ?            ?            ?            38.954     90           ?         ?            
1 1 1 18 0  4  x 0 ?        ?         ?            ?            ?            ?            42.6563    180          ?         ?            
1 1 1 18 0  5  x 0 ?        ?         ?            ?            ?            ?            196.35     -90          ?         ?            
1 1 1 18 0  6  x 0 ?        ?         ?            ?            ?            ?            20.0996    -180         ?         ?            
1 1 1 18 1  0  x 0 ?        ?         ?            ?            ?            ?            107.861    -2.60093e-14 ?         ?            
1 1 1 18 1  1  x 0 ?        ?         ?            ?            ?            ?            137.478    149.151      ?         ?            
1 1 1 18 1  2  x 0 ?        ?         ?            ?            ?            ?            72.1825    34.1763      ?         ?            
1 1 1 18 1  3  x 0 ?        ?         ?            ?            ?            ?            104.941    -176.366     ?         ?            
1 1 1 18 1  4  x 0 ?        ?         ?            ?            ?            ?            110.777    -162.93      ?         ?            
1 1 1 18 1  5  x 0 ?        ?         ?            ?            ?            ?            64.7313    75.8972      ?         ?            
1 1 1 18 1  6  x 0 ?        ?         ?            ?            ?            ?            116.714    179.327      ?         ?            
1 1 1 18 2  0  x 0 ?        ?         ?            ?            ?            ?            46.8881    8.56946e-15  ?         ?            
1 1 1 18 2  1  x 0 ?        ?         ?            ?            ?            ?            96.4369    -84.5088     ?         ?            
1 1 1 18 2  2  x 0 ?        ?         ?            ?            ?            ?            83.6838    102.116      ?         ?            
1 1 1 18 2  3  x 0 ?        ?         ?            ?            ?            ?            55.0269    59.8992      ?         ?            
1 1 1 18 2  4  x 0 ?        ?         ?            ?            ?            ?            85.3043    54.4029      ?         ?            
1 1 1 18 2  5  x 0 ?        ?         ?            ?            ?            ?            81.3078    106.399      ?         ?            
1 1 1 18 2  6  x 0 ?        ?         ?            ?            ?            ?            99.4124    75.7616      ?         ?            
1 1 1 18 3  0  x 0 ?        ?         ?            ?            ?            ?            29.1649    -6.22638e-14 ?         ?            
1 1 1 18 3  1  x 0 ?        ?         ?            ?            ?            ?            19.7443    14.2039      ?         ?            
1 1 1 18 3  2  x 0 ?        ?         ?            ?            ?            ?            39.0788    117.203      ?         ?            
1 1 1 18 3  3  x 0 ?        ?         ?            ?            ?            ?            55.9886    -34.3838     ?         ?            
1 1 1 18 3  4  x 0 ?        ?         ?            ?            ?            ?            75.1231    -26.2979     ?         ?            
1 1 1 18 3  5  x 0 ?        ?         ?            ?            ?            ?            54.9028    -13.8413     ?         ?            
1 1 1 18 4  0  x 0 ?        ?         ?            ?            ?            ?            61.0384    180          ?         ?            
1 1 1 18 4  1  x 0 ?        ?         ?            ?            ?            ?            82.3713    -129.818     ?         ?            
1 1 1 18 4  2  x 0 ?        ?         ?            ?            ?            ?            62.5029    -101.308     ?         ?            
1 1 1 18 4  3  x 0 ?        ?         ?            ?            ?            ?            102.339    -158.576     ?         ?            
1 1 1 18 4  4  x 0 ?        ?         ?            ?            ?            ?            28.0725    -165.089     ?         ?            
1 1 1 18 5  0  x 0 ?        ?         ?            ?            ?            ?            21.0364    180          ?         ?            
1 1 1 18 5  1  x 0 ?        ?         ?            ?            ?            ?            58.575     71.5823      ?         ?            
1 1 1 18 5  2  x 0 ?        ?         ?            ?            ?            ?            45.1965    -143.668     ?         ?            
1 1 1 18 5  3  x 0 ?        ?         ?            ?            ?            ?            72.5837    -157.453     ?         ?            
# 
#END OF REFLECTIONS
