0 mol 12 unq 0 iso 0 dist 7.68446 4.80294 7.99569 6.65672 6.1378 9.8142 numMergedOcc 0
1 mol 24 unq 0 iso 0 dist 4.78749 6.2838 8.3964 5.42968 10.0962 7.85986 numMergedOcc 0
2 mol 24 unq 1 iso 0 dist 4.78749 6.2838 8.3964 5.94343 8.56474 4.30252 numMergedOcc 0
3 mol 34 unq 0 iso 0 dist 9.3613 10.5928 8.58962 14.553 7.65753 7.37118 numMergedOcc 0
4 mol 36 unq 0 iso 0 dist 4.32337 6.99697 9.53334 6.78857 4.28628 8.37681 numMergedOcc 0
5 mol 85 unq 0 iso 0 dist 6.30598 10.6525 8.83135 17.984 14.6513 8.04853 numMergedOcc 0
6 mol 85 unq 1 iso 0 dist 6.30598 10.6525 8.83135 11.9168 9.99421 6.46549 numMergedOcc 0
7 mol 98 unq 0 iso 0 dist 7.29309 5.91879 7.48563 5.58102 7.22521 7.55367 numMergedOcc 0
8 mol 102 unq 0 iso 0 dist 6.7095 11.7136 9.2062 9.00369 6.04036 6.07633 numMergedOcc 0
9 mol 128 unq 0 iso 0 dist 7.94925 10.172 7.61237 9.38 8.12622 7.4442 numMergedOcc 0
10 mol 141 unq 0 iso 0 dist 8.3097 14.894 8.71007 15.2252 9.65579 6.90583 numMergedOcc 0
11 mol 141 unq 1 iso 0 dist 8.3097 14.894 8.71007 9.22913 5.93647 6.75593 numMergedOcc 0
12 mol 141 unq 2 iso 0 dist 8.3097 14.894 8.71007 10.061 8.51016 8.83562 numMergedOcc 0
13 mol 188 unq 0 iso 0 dist 6.07498 4.75808 6.20426 11.5231 8.6599 8.4784 numMergedOcc 0
14 mol 205 unq 0 iso 0 dist 9.54443 8.78075 6.23057 12.9931 4.51847 6.81516 numMergedOcc 0
15 mol 205 unq 1 iso 0 dist 9.54443 8.78075 6.23057 16.5352 13.1148 9.17562 numMergedOcc 0
16 mol 217 unq 0 iso 0 dist 7.70005 4.54018 7.63191 11.1161 9.311 8.4493 numMergedOcc 0
17 mol 261 unq 0 iso 0 dist 9.66298 11.7392 6.45102 8.55479 4.30068 9.41212 numMergedOcc 0
18 mol 266 unq 0 iso 0 dist 6.20998 7.30886 6.77259 12.1001 12.1427 7.63543 numMergedOcc 0
19 mol 266 unq 1 iso 0 dist 9.46926 15.6565 9.54381 14.7569 6.09382 9.32971 numMergedOcc 0
