0 mol 20 unq 0 iso 0 dist 5.49589 5.06612 5.11883 7.84796 4.9399 8.72023 numMergedOcc 0
1 mol 42 unq 0 iso 0 dist 9.36981 6.30917 6.83373 6.14934 7.72347 9.53458 numMergedOcc 0
2 mol 42 unq 1 iso 0 dist 9.36981 6.30917 6.83373 8.04675 5.65461 9.16649 numMergedOcc 0
3 mol 56 unq 0 iso 0 dist 9.12746 5.8069 7.3576 11.5236 11.2895 6.77886 numMergedOcc 0
4 mol 120 unq 0 iso 0 dist 5.71964 6.69527 9.23243 13.618 12.4334 8.93905 numMergedOcc 0
5 mol 148 unq 0 iso 0 dist 9.62458 3.97123 6.49708 11.2295 5.29844 9.02318 numMergedOcc 0
6 mol 148 unq 1 iso 0 dist 9.62458 3.97123 6.49708 10.5375 6.55924 9.74542 numMergedOcc 0
7 mol 148 unq 2 iso 0 dist 9.62458 3.97123 6.49708 7.38138 9.61708 7.97543 numMergedOcc 0
8 mol 150 unq 0 iso 0 dist 9.64273 3.98367 6.45018 10.4957 6.62435 9.6606 numMergedOcc 0
9 mol 150 unq 1 iso 0 dist 9.64273 3.98367 6.45018 7.34423 9.72618 7.85526 numMergedOcc 0
10 mol 150 unq 2 iso 0 dist 9.64273 3.98367 6.45018 11.2386 5.50847 8.94552 numMergedOcc 0
11 mol 171 unq 0 iso 0 dist 5.54827 5.9285 7.75632 10.4371 8.62666 7.71426 numMergedOcc 0
12 mol 171 unq 1 iso 0 dist 5.54827 5.9285 7.75632 10.51 11.8746 5.10618 numMergedOcc 0
13 mol 171 unq 2 iso 0 dist 5.54827 5.9285 7.75632 10.8952 9.0509 9.86681 numMergedOcc 0
14 mol 252 unq 0 iso 0 dist 8.69831 5.01742 6.5058 10.9943 7.15243 6.11473 numMergedOcc 0
15 mol 252 unq 1 iso 0 dist 8.69831 9.65981 6.77555 10.9943 7.15243 8.47784 numMergedOcc 0
16 mol 252 unq 2 iso 0 dist 8.69831 9.65981 6.77555 13.703 7.18984 8.66469 numMergedOcc 0
17 mol 272 unq 0 iso 0 dist 5.15197 6.43352 7.64992 7.66615 5.99934 9.19033 numMergedOcc 0
18 mol 276 unq 0 iso 0 dist 8.34851 16.1562 9.2211 19.3669 13.6248 6.70215 numMergedOcc 0
19 mol 276 unq 1 iso 0 dist 8.34851 16.1562 9.2211 21.0103 13.7566 7.25423 numMergedOcc 0
20 mol 276 unq 2 iso 0 dist 8.34851 16.1562 9.2211 21.5185 13.2807 7.88706 numMergedOcc 0
21 mol 276 unq 3 iso 0 dist 8.34851 16.1562 9.2211 11.1355 6.04845 7.23916 numMergedOcc 0
22 mol 276 unq 4 iso 0 dist 9.97781 12.3609 9.2211 18.9172 13.6248 6.70215 numMergedOcc 0
23 mol 276 unq 5 iso 0 dist 9.97781 12.3609 9.2211 17.5531 13.7566 7.25423 numMergedOcc 0
24 mol 276 unq 6 iso 0 dist 9.97781 12.3609 9.2211 13.5093 13.2807 7.88706 numMergedOcc 0
25 mol 276 unq 7 iso 0 dist 9.97781 12.3609 9.2211 14.7072 6.04845 7.23916 numMergedOcc 0
