0 mol 26 unq 0 iso 0 dist 7.10804 14.4334 8.65828 10.6139 4.52042 9.80897 numMergedOcc 0
1 mol 26 unq 1 iso 0 dist 8.64424 8.23892 8.65828 7.34549 4.52042 9.80897 numMergedOcc 0
2 mol 34 unq 0 iso 0 dist 9.10681 6.10527 4.50643 10.7835 4.30086 7.78892 numMergedOcc 0
3 mol 46 unq 0 iso 0 dist 8.55825 5.83937 9.52298 11.32 6.59405 9.86627 numMergedOcc 0
4 mol 46 unq 1 iso 0 dist 9.30086 7.50884 9.52298 10.156 6.59405 9.86627 numMergedOcc 0
5 mol 68 unq 0 iso 0 dist 8.52142 4.3044 5.48997 10.6232 9.32604 9.40333 numMergedOcc 0
6 mol 114 unq 0 iso 0 dist 6.56066 12.0473 8.75093 10.7548 4.24853 8.14429 numMergedOcc 0
7 mol 133 unq 0 iso 0 dist 7.55581 6.14253 5.92836 8.94909 14.5299 9.47554 numMergedOcc 0
8 mol 133 unq 1 iso 0 dist 7.55581 4.88407 4.73804 9.83788 7.72006 9.19659 numMergedOcc 0
9 mol 172 unq 0 iso 0 dist 9.40213 11.0444 5.28889 14.0537 5.25252 5.44495 numMergedOcc 0
10 mol 172 unq 1 iso 0 dist 9.40213 11.0444 5.28889 16.7117 9.10992 9.54742 numMergedOcc 0
11 mol 172 unq 2 iso 0 dist 9.40213 9.70426 4.90175 14.0537 5.25252 9.18538 numMergedOcc 0
12 mol 172 unq 3 iso 0 dist 8.75042 7.0455 5.28889 10.0098 5.25252 5.44495 numMergedOcc 0
13 mol 172 unq 4 iso 0 dist 8.75042 7.0455 5.28889 11.231 9.10992 9.54742 numMergedOcc 0
14 mol 172 unq 5 iso 0 dist 8.75042 12.33 4.90175 10.0098 5.25252 9.18538 numMergedOcc 0
15 mol 212 unq 0 iso 0 dist 9.25573 4.25603 7.98724 12.7944 6.09177 9.55058 numMergedOcc 0
16 mol 274 unq 0 iso 0 dist 9.92578 6.42452 7.79173 9.41951 7.26296 9.65027 numMergedOcc 0
17 mol 280 unq 0 iso 0 dist 7.11605 7.87626 6.38295 12.5446 8.30978 5.41639 numMergedOcc 0
18 mol 280 unq 1 iso 0 dist 7.11605 7.87626 6.38295 12.4467 5.80223 7.96485 numMergedOcc 0
