0 mol 2 unq 0 iso 0 dist 8.5893 4.00237 5.74846 5.42021 11.5155 6.89072 numMergedOcc 0
1 mol 2 unq 1 iso 0 dist 8.29974 4.00237 4.93584 5.42021 8.29487 6.89072 numMergedOcc 0
2 mol 2 unq 2 iso 0 dist 5.88525 6.42073 5.74846 13.2687 11.5155 6.89072 numMergedOcc 0
3 mol 2 unq 3 iso 0 dist 8.73586 6.42073 4.93584 13.2687 8.29487 6.89072 numMergedOcc 0
4 mol 20 unq 0 iso 0 dist 7.68085 10.7036 8.65986 15.4619 9.33614 8.93826 numMergedOcc 0
5 mol 20 unq 1 iso 0 dist 7.68085 10.7036 8.65986 13.1018 6.48654 7.17695 numMergedOcc 0
6 mol 20 unq 2 iso 0 dist 7.68085 10.0419 9.39462 13.1018 6.48654 9.33207 numMergedOcc 0
7 mol 20 unq 3 iso 0 dist 8.45034 10.7036 9.74724 15.4619 12.0458 8.93826 numMergedOcc 0
8 mol 20 unq 4 iso 0 dist 8.45034 10.7036 9.74724 13.1018 8.39164 7.17695 numMergedOcc 0
9 mol 20 unq 5 iso 0 dist 8.45034 10.0419 9.13347 13.1018 8.39164 9.33207 numMergedOcc 0
10 mol 59 unq 0 iso 0 dist 8.11934 4.82623 6.10199 5.81747 6.8954 4.90216 numMergedOcc 0
11 mol 78 unq 0 iso 0 dist 9.739 14.5346 9.86479 21.117 14.9274 6.73466 numMergedOcc 0
12 mol 81 unq 0 iso 0 dist 8.18695 5.82911 5.2168 5.96486 8.74391 9.53663 numMergedOcc 0
13 mol 81 unq 1 iso 0 dist 7.82027 7.93947 5.2168 13.9142 8.74391 9.53663 numMergedOcc 0
14 mol 88 unq 0 iso 0 dist 6.64933 4.56066 9.06249 10.1502 9.38171 9.40699 numMergedOcc 0
15 mol 90 unq 0 iso 0 dist 9.64544 9.79765 9.33968 11.2844 5.69354 6.10053 numMergedOcc 0
16 mol 148 unq 0 iso 0 dist 9.64841 10.0491 8.88297 10.165 3.78181 6.81449 numMergedOcc 0
17 mol 150 unq 0 iso 0 dist 9.5865 9.98843 8.82984 10.1549 3.72958 6.87593 numMergedOcc 0
18 mol 154 unq 0 iso 0 dist 9.19804 6.10428 9.82522 15.7514 13.9898 9.99331 numMergedOcc 0
19 mol 154 unq 1 iso 0 dist 9.19804 6.10428 9.82522 13.5319 11.0213 8.44389 numMergedOcc 0
20 mol 162 unq 0 iso 0 dist 8.99034 10.0292 9.67872 10.1999 10.7014 9.067 numMergedOcc 0
21 mol 185 unq 0 iso 0 dist 6.83972 5.80135 8.22259 9.56016 4.27185 8.07469 numMergedOcc 0
22 mol 185 unq 1 iso 0 dist 7.6878 8.64775 8.22259 10.1555 4.27185 8.07469 numMergedOcc 0
23 mol 205 unq 0 iso 0 dist 9.67328 5.83113 5.69652 12.5832 12.6877 8.87165 numMergedOcc 0
24 mol 222 unq 0 iso 0 dist 8.33743 9.08651 8.47836 10.9808 6.37759 4.90656 numMergedOcc 0
25 mol 274 unq 0 iso 0 dist 9.35835 7.72539 8.87546 13.3762 8.28273 8.25703 numMergedOcc 0
26 mol 277 unq 0 iso 0 dist 5.56721 4.20802 6.12608 12.0244 13.6282 8.24013 numMergedOcc 0
27 mol 283 unq 0 iso 0 dist 7.81415 15.5185 9.74797 8.36393 3.27256 9.35302 numMergedOcc 0
28 mol 283 unq 1 iso 0 dist 7.81415 6.35533 9.90494 8.36393 3.27256 8.85163 numMergedOcc 0
29 mol 286 unq 0 iso 0 dist 9.96295 8.1401 6.87255 13.3477 6.41589 8.87916 numMergedOcc 0
30 mol 286 unq 1 iso 0 dist 8.95266 9.30848 6.87255 5.03123 6.41589 8.87916 numMergedOcc 0
