0 mol 7 unq 0 iso 0 dist 9.20552 15.1647 8.41585 16.2149 14.7759 9.68596 14.4965 12.8323 9.87885 10.1841 numMergedOcc 0
1 mol 24 unq 0 iso 0 dist 7.40392 8.23069 5.54419 8.56483 5.59311 8.70827 10.2624 4.82629 6.6219 4.04519 numMergedOcc 0
2 mol 24 unq 1 iso 0 dist 7.40392 8.23069 5.54419 8.56483 5.59311 8.70827 13.5967 10.1698 5.68215 13.7009 numMergedOcc 0
3 mol 24 unq 2 iso 0 dist 7.40392 8.23069 5.54419 13.3777 12.176 6.73939 10.2624 4.82629 6.6219 12.5545 numMergedOcc 0
4 mol 24 unq 3 iso 0 dist 7.40392 8.23069 5.54419 13.3777 12.176 6.73939 13.5967 10.1698 5.68215 4.08755 numMergedOcc 0
5 mol 24 unq 4 iso 0 dist 7.40392 8.59466 7.36323 8.56483 5.59311 9.12854 13.1831 6.28159 8.87744 9.86385 numMergedOcc 0
6 mol 24 unq 5 iso 0 dist 7.40392 8.59466 7.36323 8.56483 5.59311 9.12854 11.0243 5.50396 7.27472 10.4353 numMergedOcc 0
7 mol 72 unq 0 iso 0 dist 5.48831 13.0773 9.96708 14.4253 11.6378 9.27838 11.3204 7.47371 7.12321 14.005 numMergedOcc 0
8 mol 85 unq 0 iso 0 dist 9.9795 13.0232 6.19965 15.5866 8.09967 7.54568 13.066 4.41789 7.7068 4.93735 numMergedOcc 0
9 mol 95 unq 0 iso 0 dist 7.90775 4.16047 9.03572 8.4204 13.3662 9.49454 8.57607 4.99174 8.27883 15.7954 numMergedOcc 0
10 mol 95 unq 1 iso 0 dist 7.90775 4.16047 9.03572 8.4204 13.3662 9.49454 6.1991 4.46005 5.75428 10.4348 numMergedOcc 0
11 mol 95 unq 2 iso 0 dist 7.90775 4.16047 9.03572 8.4204 13.3662 9.49454 5.96246 8.28518 8.57395 5.88327 numMergedOcc 0
12 mol 95 unq 3 iso 0 dist 7.90775 4.16047 9.03572 8.4204 13.3662 9.49454 10.1197 15.917 9.85409 3.96826 numMergedOcc 0
13 mol 98 unq 0 iso 0 dist 9.83528 12.3158 5.08437 11.7625 7.06961 6.7117 11.8912 3.9764 5.10496 3.94967 numMergedOcc 0
14 mol 98 unq 1 iso 0 dist 9.83528 8.06684 6.10456 11.7625 7.06961 4.47349 15.2524 10.4782 7.54889 3.92737 numMergedOcc 0
15 mol 98 unq 2 iso 0 dist 9.83528 8.06684 6.10456 11.7625 7.06961 4.47349 11.8912 3.9764 5.2571 3.94967 numMergedOcc 0
16 mol 98 unq 3 iso 0 dist 7.54969 11.7493 5.08437 9.49967 7.06961 6.7117 8.79016 3.9764 5.10496 3.94967 numMergedOcc 0
17 mol 98 unq 4 iso 0 dist 7.54969 5.15322 6.10456 9.49967 7.06961 4.47349 12.301 10.4782 7.54889 3.92737 numMergedOcc 0
18 mol 98 unq 5 iso 0 dist 7.54969 5.15322 6.10456 9.49967 7.06961 4.47349 8.79016 3.9764 5.2571 3.94967 numMergedOcc 0
19 mol 113 unq 0 iso 0 dist 9.70016 13.2553 5.86073 17.7779 10.1816 8.8822 11.6773 5.70579 8.80934 7.1951 numMergedOcc 0
20 mol 113 unq 1 iso 0 dist 9.70016 13.2553 5.86073 15.4081 8.42718 9.66219 11.6773 5.70579 8.80934 3.84573 numMergedOcc 0
21 mol 133 unq 0 iso 0 dist 7.5055 10.9541 8.22656 16.7357 10.6025 7.71248 10.7738 4.88025 8.26547 8.88402 numMergedOcc 0
22 mol 134 unq 0 iso 0 dist 8.84656 10.879 6.37586 7.85849 5.29786 6.23142 14.395 10.8635 9.33094 6.93712 numMergedOcc 0
23 mol 134 unq 1 iso 0 dist 8.84656 16.7911 9.71307 7.85849 5.29786 9.94764 18.4308 15.0225 9.1998 11.5269 numMergedOcc 0
24 mol 134 unq 2 iso 0 dist 8.84656 16.7911 9.71307 7.85849 5.29786 9.94764 14.395 10.8635 8.69531 6.93712 numMergedOcc 0
25 mol 134 unq 3 iso 0 dist 4.9155 10.879 6.49416 7.85849 5.71679 6.23142 14.395 12.3479 9.33094 6.93712 numMergedOcc 0
26 mol 134 unq 4 iso 0 dist 8.49987 10.9399 6.49416 10.2775 5.71679 6.23142 14.5869 12.3479 9.33094 6.93712 numMergedOcc 0
27 mol 134 unq 5 iso 0 dist 9.42271 7.07625 6.49416 6.08299 5.71679 6.23142 6.14652 12.3479 9.33094 6.93712 numMergedOcc 0
28 mol 143 unq 0 iso 0 dist 7.73769 7.36837 5.99315 9.01311 6.48978 7.78652 11.8017 13.1926 7.36975 12.207 numMergedOcc 0
29 mol 143 unq 1 iso 0 dist 7.73769 7.36837 5.99315 9.01311 6.48978 7.78652 12.3347 7.39837 5.40637 10.0079 numMergedOcc 0
30 mol 143 unq 2 iso 0 dist 7.73769 7.36837 5.99315 11.1518 5.20762 8.91301 11.8017 13.1926 7.36975 14.7271 numMergedOcc 0
31 mol 143 unq 3 iso 0 dist 7.73769 7.36837 5.99315 11.1518 5.20762 8.91301 12.3347 7.39837 5.40637 9.05366 numMergedOcc 0
32 mol 167 unq 0 iso 0 dist 6.53913 12.4033 9.87651 16.4519 13.0123 9.67741 12.4675 7.87971 7.20495 5.43662 numMergedOcc 0
33 mol 167 unq 1 iso 0 dist 6.53913 12.4033 9.87651 16.4519 13.0123 9.67741 11.4273 12.0033 9.2289 8.91275 numMergedOcc 0
34 mol 167 unq 2 iso 0 dist 6.53913 12.4033 9.87651 16.4519 13.0123 9.67741 12.8389 11.6011 7.02548 5.95858 numMergedOcc 0
35 mol 181 unq 0 iso 0 dist 9.74465 8.42326 8.03334 12.3404 7.81713 6.2479 11.0622 6.50233 9.76212 6.39406 numMergedOcc 0
36 mol 205 unq 0 iso 0 dist 9.25882 9.40714 7.80463 6.32542 6.09749 6.03688 6.32553 3.56269 6.52816 5.28417 numMergedOcc 0
37 mol 222 unq 0 iso 0 dist 7.88846 6.17038 7.54212 14.1993 13.3447 9.07471 11.0981 12.8595 6.74196 4.67663 numMergedOcc 0
38 mol 222 unq 1 iso 0 dist 7.88846 6.17038 7.54212 14.1993 13.3447 9.07471 14.5172 12.5866 8.36842 6.37382 numMergedOcc 0
39 mol 222 unq 2 iso 0 dist 7.88846 6.17038 7.54212 14.1993 13.3447 9.07471 15.5123 11.9567 9.75472 6.31322 numMergedOcc 0
