0 mol 26 unq 0 iso 0 dist 6.67455 4.21886 9.00844 9.7522 5.71065 9.80897 numMergedOcc 0
1 mol 26 unq 1 iso 0 dist 9.2772 7.45359 9.00844 13.4268 5.71065 9.80897 numMergedOcc 0
2 mol 33 unq 0 iso 0 dist 6.42569 5.5138 5.52908 13.9179 8.90634 9.79966 numMergedOcc 0
3 mol 33 unq 1 iso 0 dist 6.42569 5.5138 5.52908 10.837 7.71372 5.52992 numMergedOcc 0
4 mol 33 unq 2 iso 0 dist 9.13872 9.29927 5.52908 17.3193 8.90634 9.79966 numMergedOcc 0
5 mol 33 unq 3 iso 0 dist 9.13872 9.29927 5.52908 14.5217 7.71372 5.52992 numMergedOcc 0
6 mol 33 unq 4 iso 0 dist 7.27307 8.71323 5.52908 16.0687 8.90634 9.79966 numMergedOcc 0
7 mol 33 unq 5 iso 0 dist 7.27307 8.71323 5.52908 13.0656 7.71372 5.52992 numMergedOcc 0
8 mol 33 unq 6 iso 0 dist 5.73206 10.1727 5.52908 13.689 8.90634 9.79966 numMergedOcc 0
9 mol 33 unq 7 iso 0 dist 5.73206 10.1727 5.52908 12.2459 7.71372 5.52992 numMergedOcc 0
10 mol 63 unq 0 iso 0 dist 7.09184 3.86843 7.7106 8.94945 8.95233 5.41831 numMergedOcc 0
11 mol 64 unq 0 iso 0 dist 9.82294 4.69203 7.32896 8.99491 5.9853 8.75668 numMergedOcc 0
12 mol 64 unq 1 iso 0 dist 9.82294 4.69203 7.32896 13.8335 6.43864 9.64871 numMergedOcc 0
13 mol 64 unq 2 iso 0 dist 9.82294 4.69203 7.32896 14.6397 10.7211 9.95118 numMergedOcc 0
14 mol 69 unq 0 iso 0 dist 7.00234 8.94791 8.90763 11.4076 7.0643 7.25721 numMergedOcc 0
15 mol 69 unq 1 iso 0 dist 7.30652 4.2124 8.90763 5.47319 7.0643 7.25721 numMergedOcc 0
16 mol 181 unq 0 iso 0 dist 5.13534 4.44971 8.88938 7.41378 4.62576 9.4775 numMergedOcc 0
17 mol 181 unq 1 iso 0 dist 5.13534 4.82806 5.86442 7.41378 4.62576 4.71906 numMergedOcc 0
18 mol 195 unq 0 iso 0 dist 9.04342 13.221 9.02695 17.6255 9.9116 7.04524 numMergedOcc 0
19 mol 226 unq 0 iso 0 dist 9.03261 4.31761 9.8349 9.18697 11.0623 5.90092 numMergedOcc 0
20 mol 226 unq 1 iso 0 dist 5.71182 4.00573 6.72708 7.117 4.66606 5.90092 numMergedOcc 0
21 mol 226 unq 2 iso 0 dist 7.67573 4.31761 6.72708 9.18697 4.66606 5.90092 numMergedOcc 0
22 mol 233 unq 0 iso 0 dist 7.21531 13.8942 9.40942 14.1896 11.2631 7.41931 numMergedOcc 0
23 mol 238 unq 0 iso 0 dist 9.91128 15.2083 9.93547 14.0632 5.65008 8.6771 numMergedOcc 0
24 mol 238 unq 1 iso 0 dist 9.91128 15.2083 9.93547 19.2785 10.5857 9.58767 numMergedOcc 0
25 mol 241 unq 0 iso 0 dist 9.55645 5.85623 9.96797 9.71885 12.7003 7.73213 numMergedOcc 0
26 mol 252 unq 0 iso 0 dist 8.06694 4.32028 5.63485 9.79377 4.90903 5.82903 numMergedOcc 0
27 mol 276 unq 0 iso 0 dist 9.51555 11.9147 6.77017 14.812 5.32571 7.85804 numMergedOcc 0
28 mol 276 unq 1 iso 0 dist 9.57019 4.13451 6.77017 12.2554 6.48311 8.15803 numMergedOcc 0
