0 mol 26 unq 0 iso 0 dist 6.93801 8.98417 5.45023 10.7786 8.42581 5.497 numMergedOcc 0
1 mol 41 unq 0 iso 0 dist 7.89705 9.18836 6.32189 6.26099 5.52067 6.73801 numMergedOcc 0
2 mol 41 unq 1 iso 0 dist 7.89705 6.07294 4.85777 6.26099 5.52067 6.42834 numMergedOcc 0
3 mol 48 unq 0 iso 0 dist 7.44442 5.60663 7.89394 4.09894 10.8035 8.58829 numMergedOcc 0
4 mol 67 unq 0 iso 0 dist 6.0478 5.63802 10.8112 13.1761 17.965 9.0008 numMergedOcc 0
5 mol 67 unq 1 iso 0 dist 6.0478 5.63802 10.8112 10.6102 15.9517 9.77887 numMergedOcc 0
6 mol 73 unq 0 iso 0 dist 5.14178 6.82707 9.43915 9.24886 10.1483 8.10446 numMergedOcc 0
7 mol 79 unq 0 iso 0 dist 6.07578 6.64915 11.2341 5.79235 11.6592 5.9249 numMergedOcc 0
8 mol 79 unq 1 iso 0 dist 9.56449 6.64915 10.4197 5.79235 14.1492 5.9249 numMergedOcc 0
9 mol 92 unq 0 iso 0 dist 6.97288 7.31426 7.75408 9.81259 9.28578 7.1539 numMergedOcc 0
10 mol 92 unq 1 iso 0 dist 9.08316 6.15654 5.43086 6.3678 10.5059 6.72712 numMergedOcc 0
11 mol 92 unq 2 iso 0 dist 9.08316 6.15654 5.43086 7.31722 10.7262 5.39745 numMergedOcc 0
12 mol 128 unq 0 iso 0 dist 7.50206 7.61237 5.19611 10.8984 11.7916 6.98158 numMergedOcc 0
13 mol 128 unq 1 iso 0 dist 6.4028 7.61237 4.68499 10.8984 9.89462 6.98158 numMergedOcc 0
14 mol 173 unq 0 iso 0 dist 4.0037 9.31172 11.4153 8.94838 12.2159 6.64779 numMergedOcc 0
15 mol 194 unq 0 iso 0 dist 8.63008 8.09776 7.50057 8.91682 9.77862 9.3402 numMergedOcc 0
16 mol 204 unq 0 iso 0 dist 9.42862 9.23676 7.34336 5.64245 10.3405 7.10526 numMergedOcc 0
17 mol 279 unq 0 iso 0 dist 8.84798 7.66302 15.1378 13.6577 16.7817 9.24367 numMergedOcc 0
18 mol 284 unq 0 iso 0 dist 5.68818 4.87349 9.97867 5.83318 10.7233 6.61376 numMergedOcc 0
