0 mol 7 unq 0 iso 0 dist 9.83056 13.9585 7.21217 8.88982 6.09254 7.10621 18.3683 9.17096 7.31201 10.789 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 9.83056 13.9585 7.21217 8.88982 6.09254 7.10621 19.3325 12.4418 9.36807 10.515 numMergedOcc 0
2 mol 58 unq 0 iso 0 dist 7.93406 7.71984 7.84983 9.74058 11.5882 6.62496 11.3775 11.5448 9.64665 4.67832 numMergedOcc 0
3 mol 58 unq 1 iso 0 dist 7.93406 4.67517 9.56737 9.74058 11.5882 6.35756 12.3446 17.0485 8.89374 6.47744 numMergedOcc 0
4 mol 117 unq 0 iso 0 dist 5.38954 5.17524 7.70533 9.60425 6.29427 9.84395 9.77482 12.4058 6.62561 11.3679 numMergedOcc 0
5 mol 117 unq 1 iso 0 dist 5.38954 5.17524 7.70533 12.6233 14.3476 7.90328 9.77482 12.4058 6.62561 4.91401 numMergedOcc 0
6 mol 127 unq 0 iso 0 dist 9.78409 11.3174 8.40046 8.09965 9.75166 9.30299 10.4013 7.34983 9.81878 4.77464 numMergedOcc 0
7 mol 175 unq 0 iso 0 dist 8.12739 6.87887 5.08206 15.3581 12.1783 9.0018 13.752 11.5085 9.8589 8.22779 numMergedOcc 0
8 mol 175 unq 1 iso 0 dist 8.12739 6.87887 5.08206 12.4121 7.28617 5.6234 13.752 11.5085 9.8589 10.5631 numMergedOcc 0
9 mol 175 unq 2 iso 0 dist 8.12739 6.87887 5.08206 12.1014 5.77256 6.57069 13.752 11.5085 9.8589 7.5414 numMergedOcc 0
10 mol 178 unq 0 iso 0 dist 9.56963 16.8486 8.0974 19.6153 12.2822 6.69288 20.7589 11.6559 8.96511 10.5783 numMergedOcc 0
11 mol 178 unq 1 iso 0 dist 9.56963 16.8486 8.0974 21.2844 12.4338 6.43573 20.7589 11.6559 8.96511 5.96647 numMergedOcc 0
12 mol 178 unq 2 iso 0 dist 9.56963 16.8486 8.0974 22.6421 13.9722 7.17202 20.7589 11.6559 8.96511 12.075 numMergedOcc 0
13 mol 178 unq 3 iso 0 dist 9.56963 16.8486 8.0974 22.7133 13.5599 8.81551 20.7589 11.6559 8.96511 9.92132 numMergedOcc 0
14 mol 178 unq 4 iso 0 dist 5.95885 11.6817 8.0974 14.2652 12.2822 6.69288 16.9312 11.6559 8.96511 10.5783 numMergedOcc 0
15 mol 178 unq 5 iso 0 dist 5.95885 11.6817 8.0974 16.3683 12.4338 6.43573 16.9312 11.6559 8.96511 5.96647 numMergedOcc 0
16 mol 178 unq 6 iso 0 dist 5.95885 11.6817 8.0974 17.7618 13.9722 7.17202 16.9312 11.6559 8.96511 12.075 numMergedOcc 0
17 mol 178 unq 7 iso 0 dist 5.95885 11.6817 8.0974 18.5814 13.5599 8.81551 16.9312 11.6559 8.96511 9.92132 numMergedOcc 0
18 mol 224 unq 0 iso 0 dist 9.47309 10.5254 6.56437 12.3857 14.2632 8.95269 16.2571 11.7838 7.06793 9.36098 numMergedOcc 0
19 mol 224 unq 1 iso 0 dist 9.47309 10.5254 6.56437 12.3857 14.2632 8.95269 10.8956 10.4999 6.67585 5.29877 numMergedOcc 0
20 mol 238 unq 0 iso 0 dist 5.59164 5.77573 6.83152 12.0065 10.8336 6.57393 9.02302 6.03021 5.38637 6.20606 numMergedOcc 0
21 mol 238 unq 1 iso 0 dist 5.59164 4.67735 5.24313 11.3347 12.1448 7.31233 9.02302 6.03021 6.55759 10.4664 numMergedOcc 0
22 mol 238 unq 2 iso 0 dist 5.59164 4.67735 5.24313 11.3347 12.1448 7.31233 9.9648 5.27451 7.02475 11.2717 numMergedOcc 0
23 mol 238 unq 3 iso 0 dist 5.59164 4.67735 5.24313 11.3347 12.1448 7.31233 9.13022 6.23871 7.67322 12.6986 numMergedOcc 0
24 mol 238 unq 4 iso 0 dist 5.59164 4.67735 5.24313 11.3347 12.1448 7.31233 10.8178 11.3884 7.19008 5.17471 numMergedOcc 0
25 mol 238 unq 5 iso 0 dist 6.86905 5.88384 5.56719 10.7019 5.96552 5.72887 12.3291 14.7671 9.29858 13.069 numMergedOcc 0
26 mol 249 unq 0 iso 0 dist 8.9281 12.6924 7.29898 14.9867 6.6173 7.57994 10.7504 4.16447 8.83735 5.23473 numMergedOcc 0
27 mol 249 unq 1 iso 0 dist 8.9281 12.6924 7.29898 15.3551 8.95486 6.18582 10.7504 4.16447 8.83735 7.38675 numMergedOcc 0
28 mol 282 unq 0 iso 0 dist 5.72197 4.36798 5.67266 10.5849 9.63727 8.04483 10.7897 5.41716 8.8673 10.1236 numMergedOcc 0
29 mol 282 unq 1 iso 0 dist 5.72197 4.36798 5.67266 7.34596 4.58403 8.76532 10.7897 5.41716 8.8673 8.14825 numMergedOcc 0
30 mol 282 unq 2 iso 0 dist 5.72197 4.36798 5.67266 7.12228 5.04235 6.33524 10.7897 5.41716 8.8673 7.36881 numMergedOcc 0
