0 mol 12 unq 0 iso 0 dist 6.13335 4.85969 4.13477 5.93993 5.44478 7.44542 numMergedOcc 0
1 mol 86 unq 0 iso 0 dist 5.37706 6.17345 4.4104 6.55202 9.59708 8.32885 numMergedOcc 0
2 mol 86 unq 1 iso 0 dist 5.37706 6.17345 4.4104 5.9996 7.18799 10.3332 numMergedOcc 0
3 mol 94 unq 0 iso 0 dist 7.98923 7.81363 12.4809 5.88063 9.8158 12.8492 numMergedOcc 0
4 mol 95 unq 0 iso 0 dist 5.99463 9.35364 5.17317 6.30451 9.07757 11.3138 numMergedOcc 0
5 mol 133 unq 0 iso 0 dist 8.86332 5.63173 4.77272 11.8191 4.46578 8.61448 numMergedOcc 0
6 mol 204 unq 0 iso 0 dist 9.71975 6.32064 7.4746 8.26563 7.5696 11.1756 numMergedOcc 0
7 mol 204 unq 1 iso 0 dist 9.71975 5.29176 5.87489 8.26563 7.5696 8.40718 numMergedOcc 0
8 mol 204 unq 2 iso 0 dist 6.69026 9.19343 6.85259 8.66568 9.3369 13.2698 numMergedOcc 0
9 mol 233 unq 0 iso 0 dist 5.68392 8.36772 4.69692 5.35285 7.5099 11.8021 numMergedOcc 0
10 mol 233 unq 1 iso 0 dist 5.68392 8.83541 5.49245 5.35285 7.5099 6.87565 numMergedOcc 0
11 mol 233 unq 2 iso 0 dist 5.68392 7.55878 7.41379 5.35285 7.5099 10.4618 numMergedOcc 0
12 mol 239 unq 0 iso 0 dist 6.09318 9.80709 5.48336 6.96816 7.19924 9.05797 numMergedOcc 0
13 mol 278 unq 0 iso 0 dist 8.03252 8.79625 13.4866 12.652 9.48559 18.8514 numMergedOcc 0
14 mol 278 unq 1 iso 0 dist 8.03252 9.9609 12.3196 12.652 9.48559 16.8729 numMergedOcc 0
15 mol 287 unq 0 iso 0 dist 6.2587 6.38338 7.88871 8.65896 4.66252 12.1907 numMergedOcc 0
16 mol 288 unq 0 iso 0 dist 6.2587 6.38338 7.88871 8.65896 4.66252 12.1907 numMergedOcc 0
17 mol 289 unq 0 iso 0 dist 6.2587 6.38338 7.88871 8.65896 4.66252 12.1907 numMergedOcc 0
18 mol 292 unq 0 iso 0 dist 8.01956 9.05047 10.846 10.0218 9.20553 15.6048 numMergedOcc 0
19 mol 292 unq 1 iso 0 dist 8.01956 7.24072 9.02523 10.0218 9.20553 15.0875 numMergedOcc 0
