0 mol 48 unq 0 iso 0 dist 9.66461 4.62339 8.28883 7.77714 5.82846 8.96621 numMergedOcc 0
1 mol 48 unq 1 iso 0 dist 8.81136 10.0767 8.28883 6.46118 5.82846 8.96621 numMergedOcc 0
2 mol 54 unq 0 iso 0 dist 8.10071 9.97805 5.44539 14.205 6.83076 8.42643 numMergedOcc 0
3 mol 133 unq 0 iso 0 dist 8.72732 5.48547 7.50126 13.3866 11.2716 8.60913 numMergedOcc 0
4 mol 165 unq 0 iso 0 dist 8.19939 13.729 8.2197 18.9455 13.2511 5.5411 numMergedOcc 0
5 mol 188 unq 0 iso 0 dist 8.48704 6.28664 9.98092 5.4981 5.51595 9.68317 numMergedOcc 0
6 mol 218 unq 0 iso 0 dist 7.65181 5.42236 4.61671 13.0211 5.88377 8.73468 numMergedOcc 0
7 mol 223 unq 0 iso 0 dist 9.10041 11.687 5.75896 15.436 6.5658 7.22882 numMergedOcc 0
8 mol 233 unq 0 iso 0 dist 5.79204 5.02653 7.21238 12.2228 9.3528 8.88148 numMergedOcc 0
9 mol 250 unq 0 iso 0 dist 8.27072 7.36533 5.08366 15.1628 7.31472 9.49636 numMergedOcc 0
10 mol 258 unq 0 iso 0 dist 8.88518 3.7042 6.08181 7.42888 9.0655 7.66806 numMergedOcc 0
11 mol 266 unq 0 iso 0 dist 9.4961 10.3186 8.12204 14.8264 15.9506 9.12381 numMergedOcc 0
12 mol 266 unq 1 iso 0 dist 9.4961 10.3186 8.12204 17.0794 14.4053 8.79148 numMergedOcc 0
13 mol 266 unq 2 iso 0 dist 9.4961 10.3186 8.12204 13.2032 5.69904 8.14167 numMergedOcc 0
14 mol 266 unq 3 iso 0 dist 7.07099 7.14057 6.58277 10.8713 4.56912 9.12381 numMergedOcc 0
15 mol 266 unq 4 iso 0 dist 7.07099 7.14057 6.58277 12.818 8.89693 8.79148 numMergedOcc 0
16 mol 266 unq 5 iso 0 dist 7.07099 7.14057 6.58277 12.0157 14.5953 8.14167 numMergedOcc 0
17 mol 266 unq 6 iso 0 dist 8.3978 7.14057 8.12204 10.8713 15.9506 9.12381 numMergedOcc 0
18 mol 266 unq 7 iso 0 dist 8.3978 7.14057 8.12204 12.818 14.4053 8.79148 numMergedOcc 0
19 mol 266 unq 8 iso 0 dist 8.3978 7.14057 8.12204 12.0157 5.69904 8.14167 numMergedOcc 0
20 mol 279 unq 0 iso 0 dist 7.86721 13.271 7.2783 13.5145 8.57407 8.85972 numMergedOcc 0
