0 mol 4 unq 0 iso 0 dist 7.53929 7.02225 5.04676 9.31285 11.5093 7.41754 8.60134 3.25279 8.14612 14.3737 numMergedOcc 0
1 mol 4 unq 1 iso 0 dist 7.53929 7.02225 5.04676 8.66947 10.8758 12.1293 8.60134 3.25279 8.14612 11.1776 numMergedOcc 0
2 mol 11 unq 0 iso 0 dist 9.42607 9.05483 9.83701 6.49709 5.8961 11.0953 5.59847 5.23547 7.01011 4.10106 numMergedOcc 0
3 mol 11 unq 1 iso 0 dist 6.20956 9.05483 12.5565 6.49709 4.73237 11.0953 5.59847 6.74026 7.01011 4.10106 numMergedOcc 0
4 mol 18 unq 0 iso 0 dist 9.4649 8.24155 6.8812 8.81762 7.29441 8.58937 8.1133 12.14 6.03635 10.6667 numMergedOcc 0
5 mol 18 unq 1 iso 0 dist 9.4649 8.24155 6.8812 8.81762 7.29441 8.58937 8.44727 12.9864 11.6577 6.75472 numMergedOcc 0
6 mol 18 unq 2 iso 0 dist 9.4649 8.24155 6.8812 5.32149 10.4194 6.81904 8.1133 12.14 6.03635 4.59668 numMergedOcc 0
7 mol 18 unq 3 iso 0 dist 9.4649 8.24155 6.8812 5.32149 10.4194 6.81904 8.44727 12.9864 11.6577 5.67577 numMergedOcc 0
8 mol 18 unq 4 iso 0 dist 6.45965 8.24155 12.421 8.81762 8.32004 8.58937 8.1133 10.8265 6.03635 10.6667 numMergedOcc 0
9 mol 18 unq 5 iso 0 dist 6.45965 8.24155 12.421 8.81762 8.32004 8.58937 8.44727 3.91445 11.6577 6.75472 numMergedOcc 0
10 mol 18 unq 6 iso 0 dist 6.45965 8.24155 12.421 5.32149 6.47139 6.81904 8.1133 10.8265 6.03635 4.59668 numMergedOcc 0
11 mol 18 unq 7 iso 0 dist 6.45965 8.24155 12.421 5.32149 6.47139 6.81904 8.44727 3.91445 11.6577 5.67577 numMergedOcc 0
12 mol 56 unq 0 iso 0 dist 7.68259 8.55131 4.58417 5.84326 4.61096 5.02731 7.07124 10.6754 9.72498 6.15355 numMergedOcc 0
13 mol 68 unq 0 iso 0 dist 9.073 9.25184 13.4073 5.9651 5.71797 9.32604 6.09085 6.4113 11.1122 7.50975 numMergedOcc 0
14 mol 68 unq 1 iso 0 dist 9.073 9.43167 11.8672 5.9651 5.71797 6.38894 6.09085 6.4113 13.3205 7.50975 numMergedOcc 0
15 mol 70 unq 0 iso 0 dist 9.2794 7.68652 15.844 6.77833 5.51579 14.2824 8.63204 11.0976 9.91799 12.7012 numMergedOcc 0
16 mol 70 unq 1 iso 0 dist 9.2794 7.68652 15.844 6.77833 5.51579 14.2824 5.4014 6.92915 9.70034 8.20805 numMergedOcc 0
17 mol 122 unq 0 iso 0 dist 8.3907 9.71402 11.1283 8.47907 4.42285 11.9943 6.91978 3.65582 8.45525 6.9791 numMergedOcc 0
18 mol 134 unq 0 iso 0 dist 8.49649 9.16832 5.04704 8.31276 15.5462 16.9873 7.96353 11.0328 9.0142 15.3018 numMergedOcc 0
19 mol 134 unq 1 iso 0 dist 8.49649 9.16832 5.04704 5.79157 6.36794 6.34069 7.96353 11.0328 9.0142 10.7951 numMergedOcc 0
20 mol 134 unq 2 iso 0 dist 8.49649 9.16832 5.04704 5.50687 5.73965 5.70883 7.96353 11.0328 9.0142 5.4761 numMergedOcc 0
21 mol 134 unq 3 iso 0 dist 8.49649 9.16832 5.04704 7.30919 11.0638 7.91746 7.96353 11.0328 9.0142 5.03507 numMergedOcc 0
22 mol 195 unq 0 iso 0 dist 5.7709 8.27131 4.81261 4.78641 5.90604 5.87028 6.27266 3.7157 6.84555 5.41635 numMergedOcc 0
23 mol 205 unq 0 iso 0 dist 8.95136 6.23909 13.3124 9.25882 10.6076 9.15058 9.71147 11.9786 6.57794 6.95738 numMergedOcc 0
24 mol 205 unq 1 iso 0 dist 8.95136 6.23909 13.3124 9.25882 10.6076 9.15058 6.32553 10.0544 7.41929 3.56269 numMergedOcc 0
