0 mol 26 unq 0 iso 0 dist 8.65828 5.02457 9.00844 4.52042 9.80897 5.71065 numMergedOcc 0
1 mol 64 unq 0 iso 0 dist 5.45684 11.7446 7.32896 11.6779 8.75668 5.9853 numMergedOcc 0
2 mol 64 unq 1 iso 0 dist 5.45684 11.7446 7.32896 12.0048 9.64871 6.43864 numMergedOcc 0
3 mol 64 unq 2 iso 0 dist 5.45684 11.7446 7.32896 10.7116 9.95118 10.7211 numMergedOcc 0
4 mol 64 unq 3 iso 0 dist 7.76644 12.8925 7.32896 10.1207 8.75668 5.9853 numMergedOcc 0
5 mol 64 unq 4 iso 0 dist 7.76644 12.8925 7.32896 15.2828 9.64871 6.43864 numMergedOcc 0
6 mol 64 unq 5 iso 0 dist 7.76644 12.8925 7.32896 15.7534 9.95118 10.7211 numMergedOcc 0
7 mol 73 unq 0 iso 0 dist 6.85356 11.9879 8.31425 10.539 6.3777 5.4527 numMergedOcc 0
8 mol 73 unq 1 iso 0 dist 7.32265 9.90214 8.31425 4.91508 6.3777 5.4527 numMergedOcc 0
9 mol 131 unq 0 iso 0 dist 6.45169 4.71928 6.27699 6.92535 8.88233 5.46354 numMergedOcc 0
10 mol 172 unq 0 iso 0 dist 7.44084 7.84368 8.43951 5.78278 5.44495 6.66731 numMergedOcc 0
11 mol 172 unq 1 iso 0 dist 7.44084 7.84368 8.43951 10.5031 9.54742 9.67949 numMergedOcc 0
12 mol 172 unq 2 iso 0 dist 5.28889 10.7644 8.43951 5.25252 5.44495 6.66731 numMergedOcc 0
13 mol 172 unq 3 iso 0 dist 5.28889 10.7644 8.43951 9.10992 9.54742 9.67949 numMergedOcc 0
14 mol 198 unq 0 iso 0 dist 7.62505 4.11827 8.26735 6.95439 9.19061 5.87366 numMergedOcc 0
15 mol 220 unq 0 iso 0 dist 9.57625 10.5985 9.51136 13.0808 5.39218 13.8822 numMergedOcc 0
16 mol 222 unq 0 iso 0 dist 7.99609 6.30607 9.602 5.01062 7.73634 7.71955 numMergedOcc 0
17 mol 241 unq 0 iso 0 dist 8.89435 7.42972 9.54502 10.0597 7.73213 14.1746 numMergedOcc 0
18 mol 241 unq 1 iso 0 dist 8.89435 5.4733 9.96797 10.0597 7.73213 12.7003 numMergedOcc 0
19 mol 276 unq 0 iso 0 dist 5.54217 4.56387 9.63352 6.02816 8.15803 9.42302 numMergedOcc 0
20 mol 276 unq 1 iso 0 dist 5.54217 5.9082 6.77017 6.02816 8.15803 6.48311 numMergedOcc 0
