0 mol 7 unq 0 iso 0 dist 8.57437 9.8603 4.57188 17.7278 9.85726 11.0773 15.262 11.5784 11.8172 9.60499 numMergedOcc 0
1 mol 16 unq 0 iso 0 dist 9.56648 6.36377 5.35079 5.48395 5.84479 6.31718 12.9591 6.53177 10.8455 7.63133 numMergedOcc 0
2 mol 16 unq 1 iso 0 dist 9.56648 6.36377 5.35079 10.1011 8.67719 10.9143 12.9591 6.53177 10.8455 5.46498 numMergedOcc 0
3 mol 59 unq 0 iso 0 dist 5.70814 7.7978 6.34264 6.8958 6.48625 7.17396 10.3954 5.30842 6.05545 9.21998 numMergedOcc 0
4 mol 59 unq 1 iso 0 dist 5.58384 9.55751 6.34264 5.85228 6.48625 7.17396 10.7234 5.30842 6.05545 9.21998 numMergedOcc 0
5 mol 61 unq 0 iso 0 dist 9.67403 8.46556 11.5608 4.90701 9.62468 6.72123 11.0419 10.7369 6.86346 6.65721 numMergedOcc 0
6 mol 73 unq 0 iso 0 dist 5.58346 6.18305 5.2774 4.69583 6.89722 6.19304 11.0671 10.4716 5.4148 9.96396 numMergedOcc 0
7 mol 73 unq 1 iso 0 dist 5.58346 6.18305 5.2774 4.69583 6.89722 6.19304 13.2599 13.9156 13.3558 8.70481 numMergedOcc 0
8 mol 73 unq 2 iso 0 dist 9.10386 6.18305 5.44275 15.7901 9.68526 10.2049 11.0671 8.31041 5.4148 9.38498 numMergedOcc 0
9 mol 73 unq 3 iso 0 dist 9.10386 6.18305 5.44275 4.69583 7.26679 6.19304 11.0671 8.31041 5.4148 9.96396 numMergedOcc 0
10 mol 73 unq 4 iso 0 dist 9.10386 6.18305 5.44275 4.69583 7.26679 6.19304 13.2599 11.2674 13.3558 8.70481 numMergedOcc 0
11 mol 73 unq 5 iso 0 dist 9.10386 6.18305 5.44275 15.8603 9.30776 11.6369 11.0671 8.31041 5.4148 9.75218 numMergedOcc 0
12 mol 133 unq 0 iso 0 dist 6.23615 9.50322 14.5344 4.64588 6.11955 12.6651 5.82404 7.96098 8.18495 6.80239 numMergedOcc 0
13 mol 197 unq 0 iso 0 dist 5.79753 8.3337 8.69245 13.0113 8.64255 11.6759 16.0185 11.8861 10.6112 8.56633 numMergedOcc 0
14 mol 197 unq 1 iso 0 dist 5.79753 5.41292 4.6678 13.0113 8.64255 12.1443 16.0185 11.8861 12.5038 8.56633 numMergedOcc 0
15 mol 234 unq 0 iso 0 dist 9.36753 7.86368 6.16697 12.0816 5.89084 9.45496 12.3151 4.74041 5.88703 6.56247 numMergedOcc 0
16 mol 234 unq 1 iso 0 dist 9.36753 7.86368 6.16697 6.94762 8.47009 6.7625 12.3151 4.74041 5.88703 9.36357 numMergedOcc 0
17 mol 238 unq 0 iso 0 dist 9.46728 8.59074 16.5687 11.9383 6.83152 18.6428 18.0919 10.8336 25.1319 6.57393 numMergedOcc 0
18 mol 238 unq 1 iso 0 dist 9.46728 8.59074 16.5687 9.23693 5.24313 14.6111 14.9617 12.1448 17.126 7.31233 numMergedOcc 0
19 mol 258 unq 0 iso 0 dist 9.4886 5.73834 8.31011 11.9201 5.81927 12.6116 18.1487 9.49027 17.5682 6.97229 numMergedOcc 0
20 mol 259 unq 0 iso 0 dist 5.98006 8.06771 5.71237 6.64729 6.77279 8.13497 12.3391 7.55268 10.582 8.53687 numMergedOcc 0
21 mol 259 unq 1 iso 0 dist 5.98006 8.06771 5.71237 9.79538 9.58006 7.88519 12.3795 9.10984 4.86771 7.84554 numMergedOcc 0
22 mol 259 unq 2 iso 0 dist 5.98006 8.06771 5.71237 9.79538 9.58006 7.88519 11.1503 11.8501 6.96053 7.46176 numMergedOcc 0
23 mol 259 unq 3 iso 0 dist 5.98006 8.06771 5.71237 9.79538 9.58006 7.88519 17.0226 13.9868 10.4881 9.18903 numMergedOcc 0
24 mol 259 unq 4 iso 0 dist 5.22111 9.12507 12.3218 5.41945 7.93997 11.858 10.5892 14.8465 12.5353 7.46176 numMergedOcc 0
