0 mol 26 unq 0 iso 0 dist 8.00784 4.93779 7.84204 13.1994 15.962 9.16962 14.9827 15.4381 11.887 8.34347 numMergedOcc 0
1 mol 70 unq 0 iso 0 dist 8.19398 5.68507 5.48202 11.9672 6.93285 9.34122 16.4025 11.5684 11.0952 9.65964 numMergedOcc 0
2 mol 92 unq 0 iso 0 dist 7.36335 5.02124 7.03417 9.514 12.3859 5.81965 11.8037 9.68271 6.99832 7.4729 numMergedOcc 0
3 mol 92 unq 1 iso 0 dist 7.36335 5.02124 7.03417 13.0248 11.3622 9.70512 11.8037 9.68271 6.99832 6.82344 numMergedOcc 0
4 mol 102 unq 0 iso 0 dist 9.49592 7.99081 7.68537 12.8661 3.48119 9.94856 10.2218 5.54256 5.498 7.36792 numMergedOcc 0
5 mol 102 unq 1 iso 0 dist 5.88034 6.83631 7.68537 9.10229 3.48119 9.94856 8.17186 5.54256 5.498 7.36792 numMergedOcc 0
6 mol 142 unq 0 iso 0 dist 5.79144 5.81429 5.69323 7.57458 4.05822 7.15475 13.1936 8.04118 9.49653 9.2313 numMergedOcc 0
7 mol 142 unq 1 iso 0 dist 5.79144 5.81429 5.69323 7.57458 4.05822 7.15475 12.288 8.39035 7.53854 7.73169 numMergedOcc 0
8 mol 142 unq 2 iso 0 dist 5.79144 5.81429 5.69323 7.57458 4.05822 7.15475 14.2067 11.6454 10.3477 8.96657 numMergedOcc 0
9 mol 142 unq 3 iso 0 dist 5.79144 5.81429 5.69323 10.5524 4.7832 9.07935 13.1936 8.04118 9.49653 5.31024 numMergedOcc 0
10 mol 142 unq 4 iso 0 dist 5.79144 5.81429 5.69323 10.5524 4.7832 9.07935 12.288 8.39035 7.53854 7.26382 numMergedOcc 0
11 mol 156 unq 0 iso 0 dist 9.15935 9.73855 8.22067 11.9731 3.79489 7.36119 19.018 11.8936 11.787 8.34702 numMergedOcc 0
12 mol 156 unq 1 iso 0 dist 9.15935 9.73855 8.22067 11.9731 3.79489 7.36119 16.5733 12.1503 7.71144 9.06726 numMergedOcc 0
13 mol 156 unq 2 iso 0 dist 9.15935 9.73855 8.22067 11.9731 3.79489 7.36119 18.1491 11.8938 9.22231 8.33171 numMergedOcc 0
14 mol 156 unq 3 iso 0 dist 8.24388 10.9497 8.22067 10.8757 3.79489 7.36119 16.8259 11.8936 11.787 8.34702 numMergedOcc 0
15 mol 156 unq 4 iso 0 dist 8.24388 10.9497 8.22067 10.8757 3.79489 7.36119 15.6447 12.1503 7.71144 9.06726 numMergedOcc 0
16 mol 156 unq 5 iso 0 dist 8.24388 10.9497 8.22067 10.8757 3.79489 7.36119 17.9463 11.8938 9.22231 8.33171 numMergedOcc 0
17 mol 181 unq 0 iso 0 dist 6.19329 4.97806 7.61421 11.2315 11.618 6.71012 6.94401 11.8368 4.77278 9.1374 numMergedOcc 0
18 mol 181 unq 1 iso 0 dist 6.19329 4.97806 7.61421 11.2315 11.618 6.71012 13.9623 15.9184 9.14057 5.98885 numMergedOcc 0
19 mol 181 unq 2 iso 0 dist 6.19329 4.97806 7.61421 11.2315 11.618 6.71012 16.475 17.4077 11.6919 9.15386 numMergedOcc 0
20 mol 197 unq 0 iso 0 dist 7.06868 10.1284 9.77656 8.64255 11.9685 8.99696 11.8861 16.4908 9.82139 8.56633 numMergedOcc 0
21 mol 234 unq 0 iso 0 dist 9.8226 6.14528 5.69634 13.8661 12.7879 9.5707 21.3106 18.009 15.9563 9.45496 numMergedOcc 0
22 mol 234 unq 1 iso 0 dist 9.8226 6.14528 5.69634 13.8661 12.7879 9.5707 19.6174 15.3921 14.4106 6.7625 numMergedOcc 0
23 mol 234 unq 2 iso 0 dist 9.8226 11.1481 7.91374 15.1236 13.8525 6.25105 21.2783 16.8561 10.3337 8.34494 numMergedOcc 0
24 mol 234 unq 3 iso 0 dist 9.8226 11.1481 7.91374 15.1236 13.8525 6.25105 21.3106 18.009 11.216 6.56247 numMergedOcc 0
25 mol 234 unq 4 iso 0 dist 9.8226 11.1481 7.91374 15.1236 13.8525 6.25105 19.6174 15.3921 11.4315 9.36357 numMergedOcc 0
26 mol 234 unq 5 iso 0 dist 9.8226 11.1481 7.91374 13.8661 12.7879 7.85175 21.3106 18.009 11.216 9.45496 numMergedOcc 0
27 mol 234 unq 6 iso 0 dist 9.8226 11.1481 7.91374 13.8661 12.7879 7.85175 19.6174 15.3921 11.4315 6.7625 numMergedOcc 0
28 mol 234 unq 7 iso 0 dist 9.2653 5.43106 5.69634 12.5861 12.7879 9.5707 16.6596 18.009 15.9563 9.45496 numMergedOcc 0
29 mol 234 unq 8 iso 0 dist 9.2653 5.43106 5.69634 12.5861 12.7879 9.5707 17.5642 15.3921 14.4106 6.7625 numMergedOcc 0
30 mol 234 unq 9 iso 0 dist 9.2653 6.41546 7.91374 10.7031 13.8525 6.25105 14.9323 16.8561 10.3337 8.34494 numMergedOcc 0
31 mol 234 unq 10 iso 0 dist 9.2653 6.41546 7.91374 10.7031 13.8525 6.25105 16.6596 18.009 11.216 6.56247 numMergedOcc 0
32 mol 234 unq 11 iso 0 dist 9.2653 6.41546 7.91374 10.7031 13.8525 6.25105 17.5642 15.3921 11.4315 9.36357 numMergedOcc 0
33 mol 234 unq 12 iso 0 dist 9.2653 6.41546 7.91374 12.5861 12.7879 7.85175 16.6596 18.009 11.216 9.45496 numMergedOcc 0
34 mol 234 unq 13 iso 0 dist 9.2653 6.41546 7.91374 12.5861 12.7879 7.85175 17.5642 15.3921 11.4315 6.7625 numMergedOcc 0
35 mol 234 unq 14 iso 0 dist 8.33309 13.0843 5.69634 16.9568 12.7879 9.5707 18.4194 18.009 15.9563 9.45496 numMergedOcc 0
36 mol 234 unq 15 iso 0 dist 8.33309 13.0843 5.69634 16.9568 12.7879 9.5707 16.303 15.3921 14.4106 6.7625 numMergedOcc 0
37 mol 234 unq 16 iso 0 dist 8.33309 11.9483 7.91374 16.9439 13.8525 6.25105 15.865 16.8561 10.3337 8.34494 numMergedOcc 0
38 mol 234 unq 17 iso 0 dist 8.33309 11.9483 7.91374 16.9439 13.8525 6.25105 18.4194 18.009 11.216 6.56247 numMergedOcc 0
39 mol 234 unq 18 iso 0 dist 8.33309 11.9483 7.91374 16.9439 13.8525 6.25105 16.303 15.3921 11.4315 9.36357 numMergedOcc 0
40 mol 234 unq 19 iso 0 dist 8.33309 11.9483 7.91374 16.9568 12.7879 7.85175 18.4194 18.009 11.216 9.45496 numMergedOcc 0
41 mol 234 unq 20 iso 0 dist 8.33309 11.9483 7.91374 16.9568 12.7879 7.85175 16.303 15.3921 11.4315 6.7625 numMergedOcc 0
42 mol 259 unq 0 iso 0 dist 8.75224 11.3446 5.23503 10.0766 5.97386 6.77938 13.3027 8.25897 4.99891 5.30224 numMergedOcc 0
43 mol 259 unq 1 iso 0 dist 8.75224 11.1732 9.61028 10.0766 5.97386 7.76676 13.3027 8.25897 5.32839 5.30224 numMergedOcc 0
44 mol 265 unq 0 iso 0 dist 6.80043 10.3184 8.03604 13.4214 7.71667 6.34034 7.8929 5.7944 6.43013 8.4218 numMergedOcc 0
