0 mol 43 unq 0 iso 0 dist 8.06275 10.4413 6.20293 5.33298 8.95682 8.38399 12.0618 5.06502 5.73819 12.3649 numMergedOcc 0
1 mol 43 unq 1 iso 0 dist 8.06275 10.4413 6.20293 5.33298 8.95682 8.38399 14.4184 6.45462 8.93915 14.3789 numMergedOcc 0
2 mol 43 unq 2 iso 0 dist 8.90024 5.84171 6.20293 13.2914 8.95682 8.38399 6.84521 5.06502 5.73819 12.3649 numMergedOcc 0
3 mol 43 unq 3 iso 0 dist 8.90024 5.84171 6.20293 13.2914 8.95682 8.38399 6.78532 6.45462 8.93915 14.3789 numMergedOcc 0
4 mol 58 unq 0 iso 0 dist 9.81637 11.9429 6.62496 6.18332 5.93884 5.78774 14.9123 5.30792 6.86465 9.92355 numMergedOcc 0
5 mol 58 unq 1 iso 0 dist 9.81637 11.9429 6.62496 6.18332 5.93884 5.78774 12.4928 4.81926 6.35756 7.68678 numMergedOcc 0
6 mol 72 unq 0 iso 0 dist 9.43143 16.2349 9.96708 11.9655 9.27838 11.6378 16.5383 8.24309 9.78528 16.0048 numMergedOcc 0
7 mol 95 unq 0 iso 0 dist 6.86713 9.70895 8.03644 5.04455 9.49454 11.4333 12.4296 8.41707 7.27724 12.1092 numMergedOcc 0
8 mol 115 unq 0 iso 0 dist 9.50575 6.68557 5.11551 13.4067 6.92026 6.77806 12.88 6.5838 7.11972 5.88249 numMergedOcc 0
9 mol 115 unq 1 iso 0 dist 8.43116 4.96719 5.11551 5.19545 6.92026 6.77806 6.23645 6.5838 7.11972 5.88249 numMergedOcc 0
10 mol 115 unq 2 iso 0 dist 6.23645 4.96719 7.11972 5.19545 5.88249 6.77806 8.43116 6.5838 5.11551 6.92026 numMergedOcc 0
11 mol 115 unq 3 iso 0 dist 6.23645 6.47836 6.90986 5.19545 5.88249 5.31484 9.62812 5.67807 5.39945 6.97707 numMergedOcc 0
12 mol 133 unq 0 iso 0 dist 9.94179 6.70853 9.52634 4.77149 6.66772 4.34568 13.2418 6.69554 9.91388 9.97654 numMergedOcc 0
13 mol 133 unq 1 iso 0 dist 9.94179 6.70853 9.52634 4.77149 6.66772 4.34568 12.2738 7.6656 7.24514 7.71248 numMergedOcc 0
14 mol 133 unq 2 iso 0 dist 8.66715 14.0905 7.11802 5.05981 9.22232 16.0138 9.00172 8.18495 8.00618 12.7901 numMergedOcc 0
15 mol 133 unq 3 iso 0 dist 8.66715 14.0905 7.11802 17.5205 9.22661 5.92062 9.00172 8.18495 8.00618 13.5028 numMergedOcc 0
16 mol 133 unq 4 iso 0 dist 8.66715 14.0905 7.11802 15.4908 7.56378 6.61891 9.00172 8.18495 8.00618 11.8433 numMergedOcc 0
17 mol 133 unq 5 iso 0 dist 8.95433 11.0811 7.11802 13.7968 9.22232 16.0138 13.7786 8.18495 8.00618 12.7901 numMergedOcc 0
18 mol 133 unq 6 iso 0 dist 8.95433 11.0811 7.11802 12.0166 9.22661 5.92062 13.7786 8.18495 8.00618 13.5028 numMergedOcc 0
19 mol 133 unq 7 iso 0 dist 8.95433 11.0811 7.11802 5.14992 7.56378 6.61891 13.7786 8.18495 8.00618 11.8433 numMergedOcc 0
20 mol 134 unq 0 iso 0 dist 4.68975 9.30817 9.89303 6.64576 5.83771 7.41674 4.9155 5.79898 6.54501 7.80532 numMergedOcc 0
21 mol 134 unq 1 iso 0 dist 4.9155 9.30817 6.54501 6.64576 7.80532 7.41674 4.68975 5.79898 9.89303 5.83771 numMergedOcc 0
22 mol 134 unq 2 iso 0 dist 4.9155 10.879 6.49416 6.64576 7.80532 9.87376 10.9216 8.80819 8.94367 10.5252 numMergedOcc 0
23 mol 134 unq 3 iso 0 dist 4.9155 10.879 6.49416 6.64576 7.80532 9.87376 8.84656 5.00817 6.37586 10.7586 numMergedOcc 0
24 mol 134 unq 4 iso 0 dist 8.49987 6.47843 6.54501 5.54455 7.80532 7.41674 9.64152 5.79898 9.89303 5.83771 numMergedOcc 0
25 mol 134 unq 5 iso 0 dist 8.49987 10.9399 6.49416 5.54455 7.80532 9.87376 14.7559 8.80819 8.94367 10.5252 numMergedOcc 0
26 mol 134 unq 6 iso 0 dist 8.49987 10.9399 6.49416 5.54455 7.80532 9.87376 13.0189 5.00817 6.37586 10.7586 numMergedOcc 0
27 mol 134 unq 7 iso 0 dist 9.42271 6.16353 6.54501 5.87436 7.80532 7.41674 9.15658 5.79898 9.89303 5.83771 numMergedOcc 0
28 mol 134 unq 8 iso 0 dist 9.42271 7.07625 6.49416 5.87436 7.80532 9.87376 9.79337 8.80819 8.94367 10.5252 numMergedOcc 0
29 mol 134 unq 9 iso 0 dist 9.42271 7.07625 6.49416 5.87436 7.80532 9.87376 10.5814 5.00817 6.37586 10.7586 numMergedOcc 0
30 mol 134 unq 10 iso 0 dist 5.79157 13.0109 9.86662 12.2847 9.94764 4.57832 9.87619 6.81259 8.94367 6.23142 numMergedOcc 0
31 mol 134 unq 11 iso 0 dist 5.79157 14.1608 9.71307 12.2847 9.94764 5.29786 9.87619 6.81259 6.37586 6.23142 numMergedOcc 0
32 mol 181 unq 0 iso 0 dist 9.74465 8.42326 8.03334 5.03999 6.46704 4.43096 17.2412 13.2049 9.1374 12.4878 numMergedOcc 0
33 mol 181 unq 1 iso 0 dist 9.74465 8.42326 8.03334 13.5125 6.59025 8.04639 17.2412 13.2049 9.1374 10.6908 numMergedOcc 0
34 mol 186 unq 0 iso 0 dist 8.77347 6.05728 7.54065 10.0244 8.73217 11.7429 15.5541 13.8792 9.70748 17.7621 numMergedOcc 0
35 mol 186 unq 1 iso 0 dist 8.77347 6.05728 7.54065 10.0244 8.73217 11.7429 10.7364 5.74635 8.87694 14.2425 numMergedOcc 0
36 mol 229 unq 0 iso 0 dist 6.32302 6.52416 8.22528 6.7597 8.66332 6.65022 6.88694 5.57838 7.03423 11.1976 numMergedOcc 0
37 mol 229 unq 1 iso 0 dist 8.53615 6.81165 8.22528 5.3298 8.66332 6.65022 11.0334 5.57838 7.03423 11.1976 numMergedOcc 0
