0 mol 17 unq 0 iso 0 dist 9.99682 9.55169 16.8919 5.57445 14.3923 6.53817 numMergedOcc 0
1 mol 17 unq 1 iso 0 dist 9.38298 9.55169 13.5023 5.57445 7.34681 6.53817 numMergedOcc 0
2 mol 56 unq 0 iso 0 dist 8.78393 7.59663 3.73188 8.77769 7.43409 8.04926 numMergedOcc 0
3 mol 59 unq 0 iso 0 dist 9.56769 6.47132 8.86989 5.87975 11.0029 6.46655 numMergedOcc 0
4 mol 94 unq 0 iso 0 dist 8.30781 7.34401 4.83168 10.7815 13.434 9.10488 numMergedOcc 0
5 mol 170 unq 0 iso 0 dist 5.13315 7.665 4.81264 6.63708 4.44987 7.15418 numMergedOcc 0
6 mol 186 unq 0 iso 0 dist 8.39237 5.47189 13.4775 3.91816 10.0199 7.45401 numMergedOcc 0
7 mol 253 unq 0 iso 0 dist 8.08267 5.27188 5.32928 6.3252 11.6315 7.80525 numMergedOcc 0
8 mol 258 unq 0 iso 0 dist 6.95552 8.26503 6.96581 5.41409 10.3846 7.46199 numMergedOcc 0
9 mol 276 unq 0 iso 0 dist 7.64844 6.97104 6.91945 8.68481 11.3616 5.30976 numMergedOcc 0
10 mol 279 unq 0 iso 0 dist 8.36667 9.60619 9.98703 10.5154 13.5992 5.17586 numMergedOcc 0
11 mol 279 unq 1 iso 0 dist 6.74021 9.60619 11.6718 10.5154 14.2459 5.17586 numMergedOcc 0
