0 mol 24 unq 0 iso 0 dist 7.40392 8.56483 5.59311 8.23069 5.54419 8.70827 numMergedOcc 0
1 mol 24 unq 1 iso 0 dist 7.40392 8.56483 5.59311 8.59466 7.36323 9.12854 numMergedOcc 0
2 mol 43 unq 0 iso 0 dist 6.84521 9.35453 10.7805 5.84171 5.73819 14.0799 numMergedOcc 0
3 mol 43 unq 1 iso 0 dist 8.90024 9.35453 13.5667 13.9129 8.80331 21.0357 numMergedOcc 0
4 mol 43 unq 2 iso 0 dist 8.90024 9.35453 13.5667 5.84171 6.20293 14.0799 numMergedOcc 0
5 mol 43 unq 3 iso 0 dist 6.78532 9.35453 7.42491 5.84171 8.93915 14.0799 numMergedOcc 0
6 mol 70 unq 0 iso 0 dist 6.77833 6.13606 4.36555 5.33532 9.65964 10.9151 numMergedOcc 0
7 mol 70 unq 1 iso 0 dist 9.83265 8.42287 4.36555 7.6455 9.65964 10.9151 numMergedOcc 0
8 mol 85 unq 0 iso 0 dist 9.9795 5.20528 9.29301 9.53239 7.97049 9.82915 numMergedOcc 0
9 mol 85 unq 1 iso 0 dist 9.9795 5.20528 9.29301 13.0232 6.19965 12.0078 numMergedOcc 0
10 mol 95 unq 0 iso 0 dist 7.90775 8.4204 13.3662 4.16047 9.03572 9.49454 numMergedOcc 0
11 mol 100 unq 0 iso 0 dist 9.61812 9.58313 4.86592 11.5079 8.87449 10.8527 numMergedOcc 0
12 mol 109 unq 0 iso 0 dist 6.43255 9.88541 9.29894 6.80429 8.69985 12.4099 numMergedOcc 0
13 mol 112 unq 0 iso 0 dist 8.86938 8.65004 11.8396 4.9102 7.71338 11.5768 numMergedOcc 0
14 mol 112 unq 1 iso 0 dist 8.86938 9.86487 18.0868 4.9102 7.71338 12.9739 numMergedOcc 0
15 mol 133 unq 0 iso 0 dist 7.5055 8.91143 5.81428 10.9541 8.22656 13.5737 numMergedOcc 0
16 mol 133 unq 1 iso 0 dist 7.5055 8.91143 5.81428 5.61003 6.82262 10.9779 numMergedOcc 0
17 mol 133 unq 2 iso 0 dist 8.66715 9.29665 17.3196 14.0905 7.11802 22.5735 numMergedOcc 0
18 mol 133 unq 3 iso 0 dist 9.00172 9.29665 16.1302 13.2145 6.29155 17.4081 numMergedOcc 0
19 mol 133 unq 4 iso 0 dist 9.00172 9.29665 16.1302 15.719 6.80239 22.653 numMergedOcc 0
20 mol 133 unq 5 iso 0 dist 9.00172 9.29665 16.1302 14.0905 8.00618 22.5735 numMergedOcc 0
21 mol 134 unq 0 iso 0 dist 4.68975 7.85849 4.60632 9.30817 9.89303 7.69991 numMergedOcc 0
22 mol 134 unq 1 iso 0 dist 8.84656 7.85849 5.29786 10.879 6.37586 6.23142 numMergedOcc 0
23 mol 134 unq 2 iso 0 dist 8.84656 7.85849 5.29786 16.7911 9.71307 9.94764 numMergedOcc 0
24 mol 134 unq 3 iso 0 dist 4.9155 7.85849 5.71679 9.30817 6.54501 7.69991 numMergedOcc 0
25 mol 134 unq 4 iso 0 dist 4.9155 7.85849 5.71679 10.879 6.49416 6.23142 numMergedOcc 0
26 mol 134 unq 5 iso 0 dist 9.42271 6.08299 5.71679 6.16353 6.54501 7.69991 numMergedOcc 0
27 mol 134 unq 6 iso 0 dist 9.42271 6.08299 5.71679 7.07625 6.49416 6.23142 numMergedOcc 0
28 mol 169 unq 0 iso 0 dist 6.28961 8.59976 10.3792 5.3864 8.49164 13.9834 numMergedOcc 0
29 mol 169 unq 1 iso 0 dist 6.28961 9.71763 8.6888 5.3864 8.49164 14.7367 numMergedOcc 0
30 mol 181 unq 0 iso 0 dist 8.27794 6.02094 10.2585 4.89429 9.09537 9.85106 numMergedOcc 0
31 mol 197 unq 0 iso 0 dist 7.70631 9.3055 7.16732 12.7195 8.56633 15.5383 numMergedOcc 0
32 mol 205 unq 0 iso 0 dist 9.25882 6.32542 6.09749 9.40714 7.80463 6.03688 numMergedOcc 0
33 mol 205 unq 1 iso 0 dist 6.11505 6.79634 11.6232 9.35174 9.61492 15.8388 numMergedOcc 0
34 mol 205 unq 2 iso 0 dist 6.11505 6.79634 11.6232 11.3225 7.45763 16.0523 numMergedOcc 0
35 mol 209 unq 0 iso 0 dist 5.92907 9.17634 10.6456 5.35615 7.56373 13.9599 numMergedOcc 0
36 mol 214 unq 0 iso 0 dist 9.43611 6.90717 7.8472 11.2069 8.82096 11.9912 numMergedOcc 0
37 mol 235 unq 0 iso 0 dist 6.45574 4.46919 7.60081 6.70342 5.4638 9.55668 numMergedOcc 0
38 mol 236 unq 0 iso 0 dist 8.95071 5.27184 9.52712 18.4732 9.99038 17.3964 numMergedOcc 0
39 mol 236 unq 1 iso 0 dist 8.95071 5.27184 9.52712 12.8358 6.27581 12.6259 numMergedOcc 0
40 mol 236 unq 2 iso 0 dist 8.95071 7.98527 9.82639 18.4732 9.99038 18.6627 numMergedOcc 0
41 mol 236 unq 3 iso 0 dist 8.95071 7.98527 9.82639 12.8358 6.27581 15.8016 numMergedOcc 0
42 mol 265 unq 0 iso 0 dist 8.49415 7.87337 13.6299 4.05162 8.4218 9.58094 numMergedOcc 0
43 mol 274 unq 0 iso 0 dist 9.13226 6.74022 5.29529 10.7073 7.56915 8.52587 numMergedOcc 0
44 mol 274 unq 1 iso 0 dist 9.13226 6.74022 5.29529 11.3302 8.49997 11.6126 numMergedOcc 0
45 mol 277 unq 0 iso 0 dist 7.23956 6.71956 7.70529 15.6875 9.7748 16.795 numMergedOcc 0
46 mol 278 unq 0 iso 0 dist 9.91518 6.9592 14.3412 12.8387 8.44326 18.2538 numMergedOcc 0
