0 mol 1 unq 0 iso 0 dist 8.70365 9.34725 6.71753 6.41817 9.14815 5.19589 numMergedOcc 0
1 mol 1 unq 1 iso 0 dist 8.70365 9.30501 6.37896 6.41817 9.14815 13.1116 numMergedOcc 0
2 mol 1 unq 2 iso 0 dist 9.33719 9.34725 10.4572 6.41817 10.4951 5.19589 numMergedOcc 0
3 mol 1 unq 3 iso 0 dist 9.33719 9.30501 11.3264 6.41817 10.4951 13.1116 numMergedOcc 0
4 mol 14 unq 0 iso 0 dist 5.35021 9.54103 12.1744 9.22226 6.99296 9.81815 numMergedOcc 0
5 mol 26 unq 0 iso 0 dist 5.58467 6.85245 9.03287 9.53735 13.2487 5.60332 numMergedOcc 0
6 mol 87 unq 0 iso 0 dist 6.73874 9.99609 15.177 7.14461 11.6247 4.99645 numMergedOcc 0
7 mol 87 unq 1 iso 0 dist 6.73874 9.99609 15.177 9.03196 6.26801 12.9785 numMergedOcc 0
8 mol 87 unq 2 iso 0 dist 6.73874 7.08616 5.80857 7.14461 11.6247 10.6701 numMergedOcc 0
9 mol 87 unq 3 iso 0 dist 6.73874 7.08616 5.80857 9.03196 6.26801 10.1967 numMergedOcc 0
10 mol 87 unq 4 iso 0 dist 6.73874 7.83182 10.5488 7.14461 11.6247 7.79329 numMergedOcc 0
11 mol 87 unq 5 iso 0 dist 6.73874 7.83182 10.5488 9.03196 6.26801 12.843 numMergedOcc 0
12 mol 103 unq 0 iso 0 dist 9.0807 7.68908 8.96379 6.87901 7.15509 10.3138 numMergedOcc 0
13 mol 103 unq 1 iso 0 dist 9.0807 7.95587 10.0988 6.87901 7.15509 8.49357 numMergedOcc 0
14 mol 114 unq 0 iso 0 dist 9.03707 7.35639 12.5525 9.82907 8.92549 9.70449 numMergedOcc 0
15 mol 124 unq 0 iso 0 dist 9.69841 7.3864 5.30617 7.55095 9.30287 4.87437 numMergedOcc 0
16 mol 131 unq 0 iso 0 dist 6.30762 8.98949 10.1774 8.74658 6.14427 13.3682 numMergedOcc 0
17 mol 205 unq 0 iso 0 dist 9.10711 8.96503 14.538 9.47112 12.1273 4.79372 numMergedOcc 0
18 mol 205 unq 1 iso 0 dist 8.94211 8.96503 12.6987 9.47112 12.9768 4.79372 numMergedOcc 0
19 mol 237 unq 0 iso 0 dist 8.81333 6.73849 6.51143 6.78301 11.0048 6.57707 numMergedOcc 0
20 mol 237 unq 1 iso 0 dist 8.81333 9.43875 16.3422 6.78301 11.0048 6.45163 numMergedOcc 0
21 mol 260 unq 0 iso 0 dist 4.49691 7.68243 5.94756 6.8795 5.38535 5.45911 numMergedOcc 0
22 mol 293 unq 0 iso 0 dist 9.50932 8.84911 11.9388 8.60282 4.75112 8.37167 numMergedOcc 0
