0 mol 26 unq 0 iso 0 dist 7.54282 9.77186 6.38243 6.32127 4.76998 9.5053 numMergedOcc 0
1 mol 98 unq 0 iso 0 dist 9.29692 17.2555 8.75597 12.4011 3.94967 8.43352 numMergedOcc 0
2 mol 98 unq 1 iso 0 dist 8.71558 12.4403 8.75597 7.43804 3.94967 8.43352 numMergedOcc 0
3 mol 114 unq 0 iso 0 dist 6.68983 8.0239 7.59156 8.93293 4.08391 9.17466 numMergedOcc 0
4 mol 119 unq 0 iso 0 dist 7.79263 6.0453 9.6121 13.4131 12.8661 8.8562 numMergedOcc 0
5 mol 119 unq 1 iso 0 dist 7.79263 6.0453 9.6121 12.3107 13.3563 7.91683 numMergedOcc 0
6 mol 119 unq 2 iso 0 dist 9.9292 11.298 9.57341 14.3225 5.37917 8.8562 numMergedOcc 0
7 mol 119 unq 3 iso 0 dist 9.9292 11.298 9.57341 19.1958 15.7711 7.91683 numMergedOcc 0
8 mol 143 unq 0 iso 0 dist 8.1368 5.52955 7.16698 10.1072 6.11087 6.95372 numMergedOcc 0
9 mol 162 unq 0 iso 0 dist 8.64101 8.33753 7.86766 9.90113 9.03836 7.58035 numMergedOcc 0
10 mol 186 unq 0 iso 0 dist 9.43325 5.26093 6.07389 9.38735 5.65634 4.5271 numMergedOcc 0
11 mol 186 unq 1 iso 0 dist 9.43325 5.26093 6.07389 8.89293 3.87082 7.02575 numMergedOcc 0
12 mol 196 unq 0 iso 0 dist 8.58805 11.9967 6.25813 14.4427 7.91487 8.57986 numMergedOcc 0
13 mol 222 unq 0 iso 0 dist 7.17095 7.45292 7.97027 11.2537 4.67663 9.08955 numMergedOcc 0
14 mol 222 unq 1 iso 0 dist 7.17095 7.45292 7.97027 8.37652 4.00869 8.88664 numMergedOcc 0
15 mol 222 unq 2 iso 0 dist 7.17095 7.45292 7.97027 10.132 6.23984 7.16819 numMergedOcc 0
16 mol 250 unq 0 iso 0 dist 9.41222 9.67078 6.93875 9.5174 6.40609 5.93798 numMergedOcc 0
17 mol 284 unq 0 iso 0 dist 9.84174 7.02864 7.63256 12.5776 14.5604 9.63007 numMergedOcc 0
18 mol 285 unq 0 iso 0 dist 7.63933 9.11674 8.94601 13.054 8.85284 8.16947 numMergedOcc 0
19 mol 285 unq 1 iso 0 dist 7.63933 9.11674 8.94601 9.32133 6.3633 6.74142 numMergedOcc 0
