0 mol 8 unq 0 iso 0 dist 9.03822 9.08552 4.69349 5.12111 7.92414 6.56356 numMergedOcc 0
1 mol 76 unq 0 iso 0 dist 9.42735 8.96039 11.0792 6.71804 4.79949 9.85905 numMergedOcc 0
2 mol 76 unq 1 iso 0 dist 9.98078 8.96039 6.48293 6.71804 7.27693 9.85905 numMergedOcc 0
3 mol 130 unq 0 iso 0 dist 7.67321 9.58844 10.6057 13.9674 9.28592 18.7441 numMergedOcc 0
4 mol 171 unq 0 iso 0 dist 9.85967 9.2536 13.0558 15.1894 9.11712 19.4968 numMergedOcc 0
5 mol 171 unq 1 iso 0 dist 9.85967 9.38425 9.69361 15.1894 9.11712 13.1082 numMergedOcc 0
6 mol 186 unq 0 iso 0 dist 6.58421 7.12029 8.58039 5.77884 7.20574 6.61112 numMergedOcc 0
7 mol 186 unq 1 iso 0 dist 6.58421 7.12029 8.58039 7.02436 6.85302 11.456 numMergedOcc 0
8 mol 186 unq 2 iso 0 dist 6.58421 8.56602 9.96652 5.77884 7.20574 11.4283 numMergedOcc 0
9 mol 186 unq 3 iso 0 dist 6.58421 8.56602 9.96652 7.02436 6.85302 14.6051 numMergedOcc 0
10 mol 186 unq 4 iso 0 dist 5.31166 8.41456 11.1813 5.95114 9.56197 13.311 numMergedOcc 0
11 mol 186 unq 5 iso 0 dist 5.31166 8.41456 11.1813 5.93294 7.24795 10.6493 numMergedOcc 0
12 mol 186 unq 6 iso 0 dist 5.31166 8.41456 11.1813 8.88219 8.64409 15.4849 numMergedOcc 0
13 mol 186 unq 7 iso 0 dist 5.31166 8.41456 11.1813 7.74823 7.60202 16.1473 numMergedOcc 0
14 mol 209 unq 0 iso 0 dist 9.9518 9.73136 4.79208 11.2558 8.41195 12.7447 numMergedOcc 0
15 mol 214 unq 0 iso 0 dist 7.30003 6.91906 5.73082 5.68711 6.38157 7.46481 numMergedOcc 0
16 mol 238 unq 0 iso 0 dist 9.62121 9.40158 12.15 14.572 5.52379 14.3724 numMergedOcc 0
17 mol 259 unq 0 iso 0 dist 8.30744 9.2885 4.67584 11.2159 8.55558 11.7465 numMergedOcc 0
18 mol 259 unq 1 iso 0 dist 8.30744 9.2885 4.67584 5.43184 8.59697 8.03219 numMergedOcc 0
19 mol 264 unq 0 iso 0 dist 9.54836 7.05095 7.36132 6.46871 7.52281 5.90924 numMergedOcc 0
20 mol 264 unq 1 iso 0 dist 9.54836 7.05095 7.36132 6.62911 6.42588 9.58916 numMergedOcc 0
