0 mol 6 unq 0 iso 0 dist 8.78583 4.22722 6.70505 13.7473 10.9656 9.97675 numMergedOcc 0
1 mol 7 unq 0 iso 0 dist 6.16125 5.8785 8.19144 11.9194 9.17096 8.94874 numMergedOcc 0
2 mol 18 unq 0 iso 0 dist 8.25905 10.5553 8.95294 12.2469 9.13179 6.72533 numMergedOcc 0
3 mol 18 unq 1 iso 0 dist 8.25905 12.9137 7.19022 12.2469 9.13179 8.29216 numMergedOcc 0
4 mol 42 unq 0 iso 0 dist 8.19603 5.30941 9.88198 9.02961 5.06225 7.81641 numMergedOcc 0
5 mol 70 unq 0 iso 0 dist 8.06918 14.1904 9.76145 13.3587 5.42703 9.69751 numMergedOcc 0
6 mol 70 unq 1 iso 0 dist 8.56968 15.9614 9.76145 13.773 5.42703 9.69751 numMergedOcc 0
7 mol 70 unq 2 iso 0 dist 7.70428 9.59976 9.76145 10.6507 5.42703 9.69751 numMergedOcc 0
8 mol 71 unq 0 iso 0 dist 8.48223 5.10388 8.05492 9.05218 8.13095 4.87423 numMergedOcc 0
9 mol 71 unq 1 iso 0 dist 8.48223 5.10388 8.05492 9.95424 5.63957 7.75237 numMergedOcc 0
10 mol 71 unq 2 iso 0 dist 8.48223 5.82845 9.27619 9.05218 8.13095 4.76283 numMergedOcc 0
11 mol 105 unq 0 iso 0 dist 8.32431 11.0792 6.13301 12.6106 7.60038 9.87685 numMergedOcc 0
12 mol 141 unq 0 iso 0 dist 6.59782 6.35915 8.12409 10.2788 9.3538 9.98097 numMergedOcc 0
13 mol 184 unq 0 iso 0 dist 7.09847 9.23342 7.95111 13.4563 11.1645 5.13722 numMergedOcc 0
14 mol 193 unq 0 iso 0 dist 6.70883 12.3823 8.52642 15.82 10.9221 5.19654 numMergedOcc 0
15 mol 238 unq 0 iso 0 dist 6.89216 6.12374 5.72415 8.47921 5.1967 6.32593 numMergedOcc 0
16 mol 259 unq 0 iso 0 dist 6.18798 5.5938 8.84139 9.24368 5.36282 8.38727 numMergedOcc 0
17 mol 259 unq 1 iso 0 dist 6.18798 9.0995 9.26725 9.24368 5.36282 6.6731 numMergedOcc 0
18 mol 274 unq 0 iso 0 dist 8.8896 13.1621 9.89613 11.2274 4.05661 7.24089 numMergedOcc 0
19 mol 277 unq 0 iso 0 dist 9.28545 5.57184 8.62043 7.64708 10.0256 8.83777 numMergedOcc 0
20 mol 277 unq 1 iso 0 dist 9.28545 5.57184 8.62043 5.73065 8.46112 9.42812 numMergedOcc 0
