0 mol 17 unq 0 iso 0 dist 9.54285 10.5494 9.26685 9.54397 8.6745 4.86775 numMergedOcc 0
1 mol 36 unq 0 iso 0 dist 9.98689 6.76635 8.47497 5.06043 7.7124 4.61635 numMergedOcc 0
2 mol 62 unq 0 iso 0 dist 7.30392 10.9933 7.61631 7.34856 7.95291 5.1165 numMergedOcc 0
3 mol 74 unq 0 iso 0 dist 9.41965 8.25258 7.33612 4.43101 6.64677 4.26029 numMergedOcc 0
4 mol 126 unq 0 iso 0 dist 7.80819 4.30864 7.25133 12.415 9.93116 13.7243 numMergedOcc 0
5 mol 129 unq 0 iso 0 dist 7.48833 13.4277 8.34427 5.22333 8.57774 13.2297 numMergedOcc 0
6 mol 132 unq 0 iso 0 dist 7.14447 12.8539 8.15549 3.48657 8.62632 12.032 numMergedOcc 0
7 mol 158 unq 0 iso 0 dist 8.34722 6.26228 7.07348 5.87558 9.53944 8.38939 numMergedOcc 0
8 mol 186 unq 0 iso 0 dist 8.98221 13.6469 9.08767 3.64178 9.77333 11.7104 numMergedOcc 0
9 mol 226 unq 0 iso 0 dist 7.6174 8.00807 7.20862 9.93335 8.31266 13.7904 numMergedOcc 0
10 mol 239 unq 0 iso 0 dist 7.19924 15.6809 9.09835 6.14152 5.99355 14.486 numMergedOcc 0
11 mol 239 unq 1 iso 0 dist 7.19924 12.3037 7.21466 6.14152 5.99355 11.8914 numMergedOcc 0
12 mol 259 unq 0 iso 0 dist 9.49732 17.4311 8.91916 11.8307 8.40328 10.2743 numMergedOcc 0
13 mol 259 unq 1 iso 0 dist 9.49732 17.4311 8.91916 9.41512 8.2518 11.46 numMergedOcc 0
14 mol 259 unq 2 iso 0 dist 9.49732 12.8835 4.55368 11.8307 8.40328 7.06301 numMergedOcc 0
15 mol 259 unq 3 iso 0 dist 9.49732 12.8835 4.55368 9.41512 8.2518 7.80863 numMergedOcc 0
16 mol 283 unq 0 iso 0 dist 8.821 5.9309 7.53773 17.4818 9.83098 14.4652 numMergedOcc 0
17 mol 283 unq 1 iso 0 dist 9.82337 14.0912 8.3815 7.04213 9.19367 8.97643 numMergedOcc 0
18 mol 283 unq 2 iso 0 dist 9.82337 10.1502 7.13925 7.04213 9.19367 11.6244 numMergedOcc 0
19 mol 283 unq 3 iso 0 dist 6.3448 11.5049 8.3815 7.88011 9.19367 8.97643 numMergedOcc 0
20 mol 283 unq 4 iso 0 dist 6.3448 5.47552 7.13925 7.88011 9.19367 11.6244 numMergedOcc 0
