0 mol 25 unq 0 iso 0 dist 7.05148 8.27137 11.0175 5.89178 12.8502 9.94577 numMergedOcc 0
1 mol 54 unq 0 iso 0 dist 9.06974 7.31989 3.98261 10.6622 12.6292 8.80745 numMergedOcc 0
2 mol 58 unq 0 iso 0 dist 5.84625 8.85156 10.5604 7.63046 11.799 8.63912 numMergedOcc 0
3 mol 73 unq 0 iso 0 dist 7.57443 9.42184 12.669 10.3721 15.997 7.75341 numMergedOcc 0
4 mol 116 unq 0 iso 0 dist 7.6005 9.87191 3.82942 5.17486 6.63731 8.75205 numMergedOcc 0
5 mol 116 unq 1 iso 0 dist 8.7583 9.21528 3.82942 6.28627 6.63731 8.75205 numMergedOcc 0
6 mol 119 unq 0 iso 0 dist 9.34823 9.10803 14.1584 10.872 18.2822 6.39945 numMergedOcc 0
7 mol 119 unq 1 iso 0 dist 9.34823 9.10803 14.1584 12.1048 19.4571 7.14258 numMergedOcc 0
8 mol 128 unq 0 iso 0 dist 8.87314 9.67042 5.53655 11.5809 12.6103 7.9883 numMergedOcc 0
9 mol 128 unq 1 iso 0 dist 9.38436 8.77539 5.53655 8.38405 12.6103 7.9883 numMergedOcc 0
10 mol 141 unq 0 iso 0 dist 7.6793 5.56446 9.84473 5.05068 6.37143 7.11411 numMergedOcc 0
11 mol 195 unq 0 iso 0 dist 8.80931 8.60546 5.45812 6.64858 12.6062 9.75756 numMergedOcc 0
12 mol 205 unq 0 iso 0 dist 8.86587 8.69512 16.7363 14.2869 22.7294 8.71347 numMergedOcc 0
13 mol 206 unq 0 iso 0 dist 8.15381 8.79378 5.70985 4.58247 6.69623 5.83021 numMergedOcc 0
14 mol 206 unq 1 iso 0 dist 8.15381 8.79378 5.70985 9.70849 6.21951 9.18711 numMergedOcc 0
15 mol 219 unq 0 iso 0 dist 7.13099 6.52136 5.75906 6.90398 9.30312 8.38773 numMergedOcc 0
16 mol 223 unq 0 iso 0 dist 7.81769 9.6936 3.86668 5.59816 6.64193 9.73123 numMergedOcc 0
17 mol 223 unq 1 iso 0 dist 7.66694 9.36733 3.86668 4.04961 6.64193 9.73123 numMergedOcc 0
18 mol 225 unq 0 iso 0 dist 8.37379 9.49163 5.8463 6.31615 6.6069 9.0735 numMergedOcc 0
19 mol 292 unq 0 iso 0 dist 6.60049 7.78796 3.92782 12.3343 9.78409 6.79765 numMergedOcc 0
