0 mol 17 unq 0 iso 0 dist 6.80314 7.83348 5.16502 6.53817 4.03817 8.70792 numMergedOcc 0
1 mol 24 unq 0 iso 0 dist 8.3964 10.0962 7.85986 12.6611 5.11617 8.23075 numMergedOcc 0
2 mol 24 unq 1 iso 0 dist 8.3964 8.56474 4.30252 12.6611 5.11617 4.7841 numMergedOcc 0
3 mol 26 unq 0 iso 0 dist 8.98417 12.6093 9.11311 16.0085 10.9837 7.98005 numMergedOcc 0
4 mol 36 unq 0 iso 0 dist 9.53334 4.28628 8.37681 6.29647 5.52411 5.79779 numMergedOcc 0
5 mol 48 unq 0 iso 0 dist 6.42242 5.39197 7.20729 5.36645 8.82805 7.15542 numMergedOcc 0
6 mol 79 unq 0 iso 0 dist 9.22889 4.08459 5.79139 5.49623 6.54837 4.37025 numMergedOcc 0
7 mol 79 unq 1 iso 0 dist 6.64915 8.65653 5.79139 11.8934 6.54837 4.37025 numMergedOcc 0
8 mol 98 unq 0 iso 0 dist 7.48563 7.22521 7.55367 12.6783 14.3413 7.92856 numMergedOcc 0
9 mol 102 unq 0 iso 0 dist 9.2062 6.04036 6.07633 9.0361 4.48396 5.54256 numMergedOcc 0
10 mol 123 unq 0 iso 0 dist 9.52442 14.0666 7.30244 20.7218 14.0935 8.111 numMergedOcc 0
11 mol 147 unq 0 iso 0 dist 9.77522 9.03848 9.59327 13.1465 8.93262 6.73617 numMergedOcc 0
12 mol 147 unq 1 iso 0 dist 9.77522 5.58015 8.51399 13.1465 8.93262 9.03544 numMergedOcc 0
13 mol 162 unq 0 iso 0 dist 9.31025 7.86779 5.67088 9.89142 4.20425 7.93088 numMergedOcc 0
14 mol 162 unq 1 iso 0 dist 9.0087 5.29862 5.67088 10.8794 4.20425 7.93088 numMergedOcc 0
15 mol 188 unq 0 iso 0 dist 6.20426 8.6599 8.4784 13.843 10.5721 7.86092 numMergedOcc 0
16 mol 198 unq 0 iso 0 dist 8.28295 7.8747 8.78623 16.4953 15.6566 9.76973 numMergedOcc 0
17 mol 232 unq 0 iso 0 dist 8.27761 11.775 9.78273 10.8093 4.9377 8.25985 numMergedOcc 0
18 mol 232 unq 1 iso 0 dist 6.83927 6.92845 9.89191 14.7415 14.3553 8.60731 numMergedOcc 0
19 mol 253 unq 0 iso 0 dist 9.29788 12.9301 9.82605 13.9835 6.0964 8.93741 numMergedOcc 0
20 mol 253 unq 1 iso 0 dist 9.50983 16.4827 9.82605 15.2398 6.0964 8.93741 numMergedOcc 0
21 mol 256 unq 0 iso 0 dist 9.65136 6.51471 4.36333 9.9381 5.28793 4.80903 numMergedOcc 0
22 mol 256 unq 1 iso 0 dist 7.54955 5.24147 4.36333 8.43264 5.28793 4.80903 numMergedOcc 0
23 mol 258 unq 0 iso 0 dist 8.51736 11.4354 7.08328 12.376 4.66802 6.76495 numMergedOcc 0
24 mol 258 unq 1 iso 0 dist 8.51736 11.4354 7.08328 10.6216 6.93678 5.4557 numMergedOcc 0
25 mol 261 unq 0 iso 0 dist 6.45102 4.30068 9.41212 7.6414 6.18925 8.24356 numMergedOcc 0
26 mol 261 unq 1 iso 0 dist 9.20425 10.2597 9.41212 12.8798 6.18925 8.24356 numMergedOcc 0
