0 mol 4 unq 0 iso 0 dist 7.53929 7.02225 5.04676 8.60134 3.25279 8.14612 numMergedOcc 0
1 mol 11 unq 0 iso 0 dist 9.42607 9.05483 9.83701 5.59847 5.23547 7.01011 numMergedOcc 0
2 mol 11 unq 1 iso 0 dist 6.20956 9.05483 12.5565 5.59847 6.74026 7.01011 numMergedOcc 0
3 mol 18 unq 0 iso 0 dist 9.4649 8.24155 6.8812 8.1133 12.14 6.03635 numMergedOcc 0
4 mol 18 unq 1 iso 0 dist 9.4649 8.24155 6.8812 8.44727 12.9864 11.6577 numMergedOcc 0
5 mol 18 unq 2 iso 0 dist 6.45965 8.24155 12.421 8.1133 10.8265 6.03635 numMergedOcc 0
6 mol 18 unq 3 iso 0 dist 6.45965 8.24155 12.421 8.44727 3.91445 11.6577 numMergedOcc 0
7 mol 56 unq 0 iso 0 dist 7.68259 8.55131 4.58417 7.07124 10.6754 9.72498 numMergedOcc 0
8 mol 68 unq 0 iso 0 dist 9.073 9.25184 13.4073 6.09085 6.4113 11.1122 numMergedOcc 0
9 mol 68 unq 1 iso 0 dist 9.073 9.43167 11.8672 6.09085 6.4113 13.3205 numMergedOcc 0
10 mol 70 unq 0 iso 0 dist 9.2794 7.68652 15.844 8.63204 11.0976 9.91799 numMergedOcc 0
11 mol 70 unq 1 iso 0 dist 9.2794 7.68652 15.844 5.4014 6.92915 9.70034 numMergedOcc 0
12 mol 73 unq 0 iso 0 dist 9.60134 9.29746 11.5072 5.91019 10.0714 5.56727 numMergedOcc 0
13 mol 73 unq 1 iso 0 dist 9.75708 5.74157 6.94793 7.10218 6.7906 4.69408 numMergedOcc 0
14 mol 122 unq 0 iso 0 dist 8.3907 9.71402 11.1283 6.91978 3.65582 8.45525 numMergedOcc 0
15 mol 134 unq 0 iso 0 dist 8.49649 9.16832 5.04704 7.96353 11.0328 9.0142 numMergedOcc 0
16 mol 195 unq 0 iso 0 dist 5.7709 8.27131 4.81261 6.27266 3.7157 6.84555 numMergedOcc 0
17 mol 205 unq 0 iso 0 dist 8.95136 6.23909 13.3124 9.71147 11.9786 6.57794 numMergedOcc 0
18 mol 205 unq 1 iso 0 dist 8.95136 6.23909 13.3124 6.32553 10.0544 7.41929 numMergedOcc 0
19 mol 234 unq 0 iso 0 dist 5.65943 7.94402 9.42563 8.56943 4.86668 14.127 numMergedOcc 0
20 mol 239 unq 0 iso 0 dist 9.27632 8.99659 9.58281 6.95744 5.59638 4.90545 numMergedOcc 0
