0 mol 24 unq 0 iso 0 dist 6.60423 7.95042 4.47891 15.4638 11.5255 7.7447 numMergedOcc 0
1 mol 112 unq 0 iso 0 dist 6.78038 9.02706 8.90959 6.35793 9.34689 5.92828 numMergedOcc 0
2 mol 112 unq 1 iso 0 dist 6.78038 9.39168 4.4941 6.35793 9.34689 9.1247 numMergedOcc 0
3 mol 112 unq 2 iso 0 dist 6.47042 8.47988 8.90959 4.69658 9.34689 5.92828 numMergedOcc 0
4 mol 112 unq 3 iso 0 dist 6.47042 8.0427 4.4941 4.69658 9.34689 9.1247 numMergedOcc 0
5 mol 142 unq 0 iso 0 dist 9.17106 7.81207 9.38687 4.05822 9.80578 5.42679 numMergedOcc 0
6 mol 143 unq 0 iso 0 dist 8.41611 5.40637 6.16103 6.75249 7.22 6.60366 numMergedOcc 0
7 mol 143 unq 1 iso 0 dist 7.63338 5.40637 8.4697 6.75249 12.0797 6.60366 numMergedOcc 0
8 mol 143 unq 2 iso 0 dist 9.03707 5.40637 5.41614 6.75249 11.1688 6.60366 numMergedOcc 0
9 mol 143 unq 3 iso 0 dist 7.25673 5.40637 6.78032 6.75249 12.5626 6.60366 numMergedOcc 0
10 mol 152 unq 0 iso 0 dist 9.77552 6.59889 4.71678 10.6994 7.34557 8.60651 numMergedOcc 0
11 mol 152 unq 1 iso 0 dist 8.28642 6.70693 4.71678 4.68615 7.34557 8.60651 numMergedOcc 0
12 mol 186 unq 0 iso 0 dist 7.20574 6.61112 8.58039 12.2442 13.1298 9.17458 numMergedOcc 0
13 mol 186 unq 1 iso 0 dist 7.20574 6.61112 8.58039 11.7398 13.243 7.36794 numMergedOcc 0
14 mol 186 unq 2 iso 0 dist 7.24795 8.73533 9.40383 12.1883 16.4753 8.17928 numMergedOcc 0
15 mol 186 unq 3 iso 0 dist 9.83476 7.2793 6.38897 4.04122 13.3578 9.34653 numMergedOcc 0
16 mol 186 unq 4 iso 0 dist 6.258 7.2793 8.88593 4.04122 6.08596 9.34653 numMergedOcc 0
17 mol 222 unq 0 iso 0 dist 8.48341 6.74196 9.0716 5.17002 12.9747 9.79673 numMergedOcc 0
18 mol 222 unq 1 iso 0 dist 8.48341 6.74196 9.0716 6.70898 13.4361 6.39673 numMergedOcc 0
19 mol 222 unq 2 iso 0 dist 8.48341 8.36842 10.5383 6.70898 13.4361 7.80676 numMergedOcc 0
20 mol 225 unq 0 iso 0 dist 6.6561 6.50998 6.35462 9.72811 14.0772 8.74463 numMergedOcc 0
21 mol 252 unq 0 iso 0 dist 6.86945 7.15764 4.34126 9.73449 11.6079 7.62991 numMergedOcc 0
22 mol 252 unq 1 iso 0 dist 6.86945 7.15764 4.34126 9.93981 8.38453 9.81261 numMergedOcc 0
23 mol 257 unq 0 iso 0 dist 9.95546 8.83833 15.1307 10.9989 20.292 7.80473 numMergedOcc 0
24 mol 264 unq 0 iso 0 dist 7.52281 5.90924 7.36132 8.3189 13.784 8.55386 numMergedOcc 0
25 mol 264 unq 1 iso 0 dist 6.42588 9.58916 7.36132 16.639 13.784 8.55386 numMergedOcc 0
26 mol 264 unq 2 iso 0 dist 6.04162 9.19754 5.82131 10.1415 12.5209 9.87744 numMergedOcc 0
27 mol 264 unq 3 iso 0 dist 6.14323 8.29262 5.82131 11.5587 12.5209 9.87744 numMergedOcc 0
28 mol 285 unq 0 iso 0 dist 5.31728 7.80862 8.05127 8.33646 11.8916 7.73438 numMergedOcc 0
