0 mol 17 unq 0 iso 0 dist 8.35273 4.79124 7.18716 6.69539 4.0384 6.76604 numMergedOcc 0
1 mol 48 unq 0 iso 0 dist 9.80453 12.4087 9.07283 8.9175 3.42062 8.38139 numMergedOcc 0
2 mol 61 unq 0 iso 0 dist 9.02073 9.10704 8.51839 6.34231 3.30756 7.61513 numMergedOcc 0
3 mol 62 unq 0 iso 0 dist 6.0827 8.53924 7.49792 7.63855 4.29679 8.19721 numMergedOcc 0
4 mol 62 unq 1 iso 0 dist 6.0827 4.38006 6.58981 7.63855 4.29679 6.84323 numMergedOcc 0
5 mol 62 unq 2 iso 0 dist 6.0827 4.38006 6.58981 5.48766 8.07308 7.24768 numMergedOcc 0
6 mol 62 unq 3 iso 0 dist 6.0827 4.38006 6.58981 9.63139 10.3525 8.51622 numMergedOcc 0
7 mol 62 unq 4 iso 0 dist 5.23167 6.37499 6.51901 6.75432 3.70802 8.19721 numMergedOcc 0
8 mol 62 unq 5 iso 0 dist 5.23167 6.37499 6.51901 8.45469 3.66673 6.84323 numMergedOcc 0
9 mol 62 unq 6 iso 0 dist 5.23167 11.7209 9.1926 8.45469 3.66673 7.24768 numMergedOcc 0
10 mol 62 unq 7 iso 0 dist 7.47607 9.79569 6.51901 10.0797 3.70802 8.19721 numMergedOcc 0
11 mol 62 unq 8 iso 0 dist 7.47607 9.79569 6.51901 10.7976 3.66673 6.84323 numMergedOcc 0
12 mol 62 unq 9 iso 0 dist 7.47607 13.1832 9.1926 10.7976 3.66673 7.24768 numMergedOcc 0
13 mol 85 unq 0 iso 0 dist 7.61514 5.40682 6.56288 6.24764 3.81285 7.52742 numMergedOcc 0
14 mol 85 unq 1 iso 0 dist 8.21116 5.40682 5.97559 6.24764 6.17121 7.52742 numMergedOcc 0
15 mol 90 unq 0 iso 0 dist 9.98861 8.14775 6.02596 12.5976 4.66066 7.38568 numMergedOcc 0
16 mol 90 unq 1 iso 0 dist 9.98861 14.9764 8.17454 12.5976 4.66066 8.6767 numMergedOcc 0
17 mol 90 unq 2 iso 0 dist 9.98861 14.9764 8.17454 19.5702 10.526 9.93577 numMergedOcc 0
18 mol 90 unq 3 iso 0 dist 5.52904 4.03085 6.02596 8.23533 4.66066 7.38568 numMergedOcc 0
19 mol 90 unq 4 iso 0 dist 5.52904 4.99029 8.17454 8.23533 4.66066 8.6767 numMergedOcc 0
20 mol 90 unq 5 iso 0 dist 5.52904 4.99029 8.17454 12.6214 10.526 9.93577 numMergedOcc 0
21 mol 93 unq 0 iso 0 dist 6.06155 4.54745 8.2702 7.04155 3.89959 9.00874 numMergedOcc 0
22 mol 176 unq 0 iso 0 dist 5.23992 3.97723 4.67031 4.60553 3.71345 6.21825 numMergedOcc 0
23 mol 176 unq 1 iso 0 dist 7.91974 3.97723 6.20326 4.60553 6.55919 6.21825 numMergedOcc 0
24 mol 176 unq 2 iso 0 dist 9.1617 3.97723 6.8243 4.60553 7.10617 6.21825 numMergedOcc 0
25 mol 239 unq 0 iso 0 dist 9.76929 7.66679 7.45508 14.6595 9.1722 9.64578 numMergedOcc 0
26 mol 239 unq 1 iso 0 dist 9.76929 7.66679 7.45508 14.395 11.2097 7.02833 numMergedOcc 0
27 mol 278 unq 0 iso 0 dist 8.69111 4.25803 7.73107 4.8627 7.14333 7.81282 numMergedOcc 0
28 mol 278 unq 1 iso 0 dist 8.69111 4.25803 7.73107 5.41035 5.40345 6.08019 numMergedOcc 0
29 mol 281 unq 0 iso 0 dist 8.78416 4.88562 9.05453 9.79394 3.86368 9.18565 numMergedOcc 0
30 mol 281 unq 1 iso 0 dist 7.82358 5.91239 9.05453 6.52115 3.86368 9.18565 numMergedOcc 0
31 mol 287 unq 0 iso 0 dist 7.96707 5.22713 6.05363 8.62338 3.76412 5.06731 numMergedOcc 0
32 mol 288 unq 0 iso 0 dist 7.96707 5.22713 6.05363 8.62338 3.76412 5.06731 numMergedOcc 0
33 mol 289 unq 0 iso 0 dist 7.96707 5.22713 6.05363 8.62338 3.76412 5.06731 numMergedOcc 0
