0 mol 7 unq 0 iso 0 dist 7.13259 5.26458 7.13214 10.4548 9.60361 6.12483 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 9.49232 15.31 7.13214 16.3136 9.60361 6.12483 numMergedOcc 0
2 mol 12 unq 0 iso 0 dist 6.13335 10.2163 7.4036 9.3276 8.79013 5.21734 numMergedOcc 0
3 mol 46 unq 0 iso 0 dist 9.57343 13.4254 6.19084 12.7344 9.72136 5.8481 numMergedOcc 0
4 mol 46 unq 1 iso 0 dist 9.57343 13.4254 6.19084 13.9221 4.61355 4.07933 numMergedOcc 0
5 mol 61 unq 0 iso 0 dist 7.70782 6.43227 7.25041 6.18292 9.65903 3.79493 numMergedOcc 0
6 mol 124 unq 0 iso 0 dist 9.08158 5.76663 7.55095 11.525 9.18988 5.88667 numMergedOcc 0
7 mol 128 unq 0 iso 0 dist 9.36937 5.8344 8.87326 12.3984 7.56557 8.16095 numMergedOcc 0
8 mol 128 unq 1 iso 0 dist 9.36937 5.8344 8.87326 9.02609 4.93016 5.53655 numMergedOcc 0
9 mol 141 unq 0 iso 0 dist 9.54996 11.0305 9.45931 13.555 7.20083 11.0215 numMergedOcc 0
10 mol 141 unq 1 iso 0 dist 9.54996 4.96213 6.35397 13.555 7.20083 10.7779 numMergedOcc 0
11 mol 148 unq 0 iso 0 dist 7.33878 6.09869 9.92375 5.13506 9.8506 5.62734 numMergedOcc 0
12 mol 158 unq 0 iso 0 dist 9.66949 5.37594 9.58371 5.29231 6.22696 8.68377 numMergedOcc 0
13 mol 205 unq 0 iso 0 dist 9.6897 8.78075 9.47112 11.0071 7.63908 5.19196 numMergedOcc 0
14 mol 213 unq 0 iso 0 dist 8.74491 5.6651 8.53661 9.36305 7.31478 12.8131 numMergedOcc 0
15 mol 214 unq 0 iso 0 dist 8.61758 11.1989 8.07237 10.6488 8.9694 3.91276 numMergedOcc 0
16 mol 250 unq 0 iso 0 dist 8.06649 14.3949 9.5174 10.3411 9.41222 6.40609 numMergedOcc 0
17 mol 287 unq 0 iso 0 dist 6.2587 7.53523 9.52718 9.8719 7.74312 5.97664 numMergedOcc 0
18 mol 288 unq 0 iso 0 dist 6.2587 7.53523 9.52718 9.8719 7.74312 5.97664 numMergedOcc 0
19 mol 289 unq 0 iso 0 dist 6.2587 7.53523 9.52718 9.8719 7.74312 5.97664 numMergedOcc 0
20 mol 292 unq 0 iso 0 dist 6.88719 6.65048 5.67671 4.14327 6.01636 6.56416 numMergedOcc 0
