0 mol 43 unq 0 iso 0 dist 7.80117 7.90905 9.79386 6.82158 8.25915 12.8294 numMergedOcc 0
1 mol 43 unq 0 iso 1 dist 9.79386 7.90905 7.80117 12.8294 8.25915 6.82158 numMergedOcc 0
2 mol 48 unq 0 iso 0 dist 7.32699 5.65467 6.45933 14.0438 9.77004 10.6879 numMergedOcc 0
3 mol 48 unq 0 iso 1 dist 6.45933 5.65467 7.32699 10.6879 9.77004 14.0438 numMergedOcc 0
4 mol 48 unq 1 iso 0 dist 7.05964 16.4417 9.90758 6.21973 9.54119 17.4974 numMergedOcc 0
5 mol 48 unq 1 iso 1 dist 9.90758 16.4417 7.05964 17.4974 9.54119 6.21973 numMergedOcc 0
6 mol 68 unq 0 iso 0 dist 9.55023 7.23402 4.39888 3.61159 9.7662 8.81593 numMergedOcc 0
7 mol 68 unq 0 iso 1 dist 4.39888 7.23402 9.55023 8.81593 9.7662 3.61159 numMergedOcc 0
8 mol 68 unq 1 iso 0 dist 9.55023 7.23402 4.39888 6.00601 6.7739 5.23849 numMergedOcc 0
9 mol 68 unq 1 iso 1 dist 4.39888 7.23402 9.55023 5.23849 6.7739 6.00601 numMergedOcc 0
10 mol 130 unq 0 iso 0 dist 8.12319 13.7304 9.04366 8.28869 6.77638 10.3345 numMergedOcc 0
11 mol 130 unq 0 iso 1 dist 9.04366 13.7304 8.12319 10.3345 6.77638 8.28869 numMergedOcc 0
12 mol 194 unq 0 iso 0 dist 7.31316 15.6462 8.9865 14.5547 9.60788 5.25176 numMergedOcc 0
13 mol 194 unq 0 iso 1 dist 8.9865 15.6462 7.31316 5.25176 9.60788 14.5547 numMergedOcc 0
14 mol 207 unq 0 iso 0 dist 7.10149 5.42513 7.18945 4.09428 9.98643 5.32879 numMergedOcc 0
15 mol 207 unq 0 iso 1 dist 7.18945 5.42513 7.10149 5.32879 9.98643 4.09428 numMergedOcc 0
16 mol 226 unq 0 iso 0 dist 7.67589 6.30547 5.94957 12.4252 9.80678 6.1912 numMergedOcc 0
17 mol 226 unq 0 iso 1 dist 5.94957 6.30547 7.67589 6.1912 9.80678 12.4252 numMergedOcc 0
18 mol 238 unq 0 iso 0 dist 5.90826 7.27957 8.75412 13.5072 9.91332 10.1453 numMergedOcc 0
19 mol 238 unq 0 iso 1 dist 8.75412 7.27957 5.90826 10.1453 9.91332 13.5072 numMergedOcc 0
20 mol 254 unq 0 iso 0 dist 8.87934 9.2376 9.47133 13.6734 9.70628 7.62172 numMergedOcc 0
21 mol 254 unq 0 iso 1 dist 9.47133 9.2376 8.87934 7.62172 9.70628 13.6734 numMergedOcc 0
22 mol 254 unq 1 iso 0 dist 9.66687 9.2376 7.61537 13.6734 7.98511 7.62172 numMergedOcc 0
23 mol 254 unq 1 iso 1 dist 7.61537 9.2376 9.66687 7.62172 7.98511 13.6734 numMergedOcc 0
24 mol 274 unq 0 iso 0 dist 7.70811 10.176 9.98144 4.74285 8.23254 6.60935 numMergedOcc 0
25 mol 274 unq 0 iso 1 dist 9.98144 10.176 7.70811 6.60935 8.23254 4.74285 numMergedOcc 0
