0 mol 53 unq 0 iso 0 dist 4.7864 5.40748 3.9531 7.88793 7.92196 9.31516 numMergedOcc 0
1 mol 54 unq 0 iso 0 dist 6.00709 7.31989 6.83617 13.255 8.51096 11.8389 numMergedOcc 0
2 mol 73 unq 0 iso 0 dist 7.70787 9.42184 12.0556 9.42024 6.00779 13.9501 numMergedOcc 0
3 mol 73 unq 1 iso 0 dist 9.57191 9.42184 4.3232 10.3721 5.52283 7.75341 numMergedOcc 0
4 mol 83 unq 0 iso 0 dist 8.79457 7.84642 8.10781 15.8461 7.40801 14.8766 numMergedOcc 0
5 mol 89 unq 0 iso 0 dist 9.91824 7.55644 7.14191 4.93796 8.49775 8.68698 numMergedOcc 0
6 mol 108 unq 0 iso 0 dist 9.10985 7.90433 11.1523 5.53105 9.01604 5.60118 numMergedOcc 0
7 mol 108 unq 1 iso 0 dist 6.23711 7.90433 7.29981 5.53105 5.37466 5.60118 numMergedOcc 0
8 mol 119 unq 0 iso 0 dist 7.46162 5.90003 12.3913 11.3405 6.58995 17.002 numMergedOcc 0
9 mol 141 unq 0 iso 0 dist 6.18881 5.56446 4.34041 5.05068 6.48738 7.11411 numMergedOcc 0
10 mol 206 unq 0 iso 0 dist 6.38964 8.79378 6.40912 9.4117 5.71819 11.931 numMergedOcc 0
11 mol 206 unq 1 iso 0 dist 6.38964 8.79378 6.40912 10.2556 8.48679 14.0863 numMergedOcc 0
12 mol 206 unq 2 iso 0 dist 6.38964 8.79378 6.40912 5.26297 9.86924 10.7174 numMergedOcc 0
13 mol 206 unq 3 iso 0 dist 6.38964 8.79378 6.40912 4.58247 7.44186 5.83021 numMergedOcc 0
14 mol 219 unq 0 iso 0 dist 8.15287 6.52136 6.08582 6.90398 6.65093 8.38773 numMergedOcc 0
15 mol 219 unq 1 iso 0 dist 8.15287 6.52136 6.08582 15.4761 9.93514 11.1562 numMergedOcc 0
16 mol 283 unq 0 iso 0 dist 7.81415 7.81241 4.24789 12.3631 5.7378 9.4181 numMergedOcc 0
17 mol 283 unq 1 iso 0 dist 7.81415 7.81241 4.24789 5.49773 7.15632 5.05882 numMergedOcc 0
18 mol 283 unq 2 iso 0 dist 7.81415 9.52445 5.57175 12.3631 5.7378 10.6234 numMergedOcc 0
19 mol 283 unq 3 iso 0 dist 7.81415 9.52445 5.57175 5.49773 7.15632 8.12067 numMergedOcc 0
