0 mol 1 unq 0 iso 0 dist 6.93809 4.73611 5.91417 10.4092 7.17521 7.23571 numMergedOcc 0
1 mol 1 unq 1 iso 0 dist 6.93809 4.73611 5.91417 11.7523 6.83338 7.85894 numMergedOcc 0
2 mol 1 unq 2 iso 0 dist 6.93809 4.73611 5.91417 7.50474 9.59537 4.79161 numMergedOcc 0
3 mol 25 unq 0 iso 0 dist 9.95169 11.6047 8.53931 6.63966 6.53269 6.06874 numMergedOcc 0
4 mol 25 unq 1 iso 0 dist 9.95169 11.6047 8.53931 7.66414 9.81524 5.16935 numMergedOcc 0
5 mol 26 unq 0 iso 0 dist 9.56639 7.35595 5.84066 5.63833 6.07276 4.98603 numMergedOcc 0
6 mol 26 unq 1 iso 0 dist 9.60699 8.52538 6.79475 6.47748 9.96912 7.26595 numMergedOcc 0
7 mol 27 unq 0 iso 0 dist 9.53382 10.1674 6.78936 7.07579 5.9635 4.39306 numMergedOcc 0
8 mol 72 unq 0 iso 0 dist 9.26417 13.1473 6.53824 15.1138 6.91169 4.67641 numMergedOcc 0
9 mol 72 unq 1 iso 0 dist 9.26417 16.7405 7.67686 15.1138 6.91169 4.5168 numMergedOcc 0
10 mol 98 unq 0 iso 0 dist 6.74197 10.1356 4.44979 8.83348 9.25444 10.2677 numMergedOcc 0
11 mol 98 unq 1 iso 0 dist 6.74197 10.1356 4.44979 14.016 8.46823 5.71029 numMergedOcc 0
12 mol 112 unq 0 iso 0 dist 7.77418 10.9659 6.12922 5.54999 6.11407 10.8329 numMergedOcc 0
13 mol 135 unq 0 iso 0 dist 8.08732 6.03033 7.6337 11.5311 7.28318 11.52 numMergedOcc 0
14 mol 135 unq 1 iso 0 dist 8.08732 6.03033 7.6337 11.0023 7.17599 7.69819 numMergedOcc 0
15 mol 135 unq 2 iso 0 dist 9.13739 4.51614 7.6337 14.7983 7.28318 11.52 numMergedOcc 0
16 mol 135 unq 3 iso 0 dist 9.13739 4.51614 7.6337 10.6553 7.17599 7.69819 numMergedOcc 0
17 mol 155 unq 0 iso 0 dist 8.14405 7.441 7.29911 5.52764 9.16358 9.50478 numMergedOcc 0
18 mol 155 unq 1 iso 0 dist 8.14405 7.441 7.29911 11.0203 9.24038 12.0574 numMergedOcc 0
19 mol 155 unq 2 iso 0 dist 8.14405 6.79302 5.36254 5.52764 9.16358 5.50045 numMergedOcc 0
20 mol 155 unq 3 iso 0 dist 8.14405 6.79302 5.36254 11.0203 9.24038 6.40403 numMergedOcc 0
21 mol 168 unq 0 iso 0 dist 5.21801 5.09374 7.06851 7.27945 9.42807 4.77731 numMergedOcc 0
22 mol 193 unq 0 iso 0 dist 8.28942 6.8779 5.79911 5.35985 8.15661 4.58486 numMergedOcc 0
23 mol 194 unq 0 iso 0 dist 9.26885 9.24953 6.11135 8.39273 9.32959 4.34256 numMergedOcc 0
24 mol 194 unq 1 iso 0 dist 9.26885 9.24953 6.11135 8.7269 8.64056 4.79043 numMergedOcc 0
25 mol 194 unq 2 iso 0 dist 9.26885 11.5934 6.54481 8.39273 9.32959 11.2817 numMergedOcc 0
26 mol 194 unq 3 iso 0 dist 9.26885 11.5934 6.54481 8.7269 8.64056 6.56076 numMergedOcc 0
27 mol 194 unq 4 iso 0 dist 9.26885 8.10542 8.03403 8.39273 9.32959 9.79708 numMergedOcc 0
28 mol 194 unq 5 iso 0 dist 9.26885 8.10542 8.03403 8.7269 8.64056 4.48495 numMergedOcc 0
29 mol 195 unq 0 iso 0 dist 5.66071 12.2974 9.74988 5.65165 9.24936 11.5313 numMergedOcc 0
30 mol 218 unq 0 iso 0 dist 8.57638 8.30209 9.59426 5.71221 8.57119 6.53543 numMergedOcc 0
31 mol 218 unq 1 iso 0 dist 8.57638 11.2606 8.61306 5.71221 8.57119 9.52657 numMergedOcc 0
32 mol 224 unq 0 iso 0 dist 5.88041 5.56344 5.73591 4.07416 5.05368 6.957 numMergedOcc 0
33 mol 224 unq 1 iso 0 dist 5.88041 7.256 8.55345 4.07416 5.05368 7.16077 numMergedOcc 0
34 mol 242 unq 0 iso 0 dist 6.1076 7.52834 6.53309 5.72074 6.31971 4.25704 numMergedOcc 0
35 mol 242 unq 1 iso 0 dist 6.34787 4.95648 6.53309 7.14203 6.31971 4.25704 numMergedOcc 0
36 mol 267 unq 0 iso 0 dist 9.5358 13.7223 5.08174 5.40977 6.27154 10.0939 numMergedOcc 0
