0 mol 10 unq 0 iso 0 dist 8.93461 3.69246 8.06428 7.21183 9.80689 7.30932 numMergedOcc 0
1 mol 26 unq 0 iso 0 dist 6.67455 3.30063 6.70325 8.62527 5.02457 8.36742 numMergedOcc 0
2 mol 26 unq 1 iso 0 dist 9.2772 6.79894 6.70325 12.0461 5.02457 8.36742 numMergedOcc 0
3 mol 32 unq 0 iso 0 dist 5.07106 3.82644 5.42426 7.6082 7.66677 6.93709 numMergedOcc 0
4 mol 32 unq 1 iso 0 dist 5.07106 3.82644 5.42426 4.09276 5.46097 6.38271 numMergedOcc 0
5 mol 32 unq 2 iso 0 dist 4.92166 3.82644 8.03553 7.6082 10.2379 6.93709 numMergedOcc 0
6 mol 32 unq 3 iso 0 dist 4.92166 3.82644 8.03553 4.09276 5.27549 6.38271 numMergedOcc 0
7 mol 46 unq 0 iso 0 dist 5.02642 9.83606 7.44805 13.1533 8.16858 8.99393 numMergedOcc 0
8 mol 154 unq 0 iso 0 dist 8.65008 11.9194 8.76245 13.3529 5.12312 8.23311 numMergedOcc 0
9 mol 154 unq 1 iso 0 dist 8.65008 11.9194 8.76245 8.5081 9.3097 6.1247 numMergedOcc 0
10 mol 158 unq 0 iso 0 dist 8.80952 17.8569 9.98554 21.7382 13.1628 5.78626 numMergedOcc 0
11 mol 158 unq 1 iso 0 dist 8.80952 17.8569 9.98554 16.8106 8.64986 9.8417 numMergedOcc 0
12 mol 168 unq 0 iso 0 dist 5.60956 6.15982 5.80055 12.187 7.66859 7.667 numMergedOcc 0
13 mol 220 unq 0 iso 0 dist 8.12934 6.43635 8.06847 6.64341 6.13765 8.67956 numMergedOcc 0
14 mol 239 unq 0 iso 0 dist 4.53228 6.29809 5.4687 13.6891 13.9377 9.29322 numMergedOcc 0
15 mol 239 unq 1 iso 0 dist 8.54078 8.19053 5.4687 15.6951 13.9377 9.29322 numMergedOcc 0
16 mol 258 unq 0 iso 0 dist 8.27336 8.73681 6.90511 12.6448 10.2996 5.57978 numMergedOcc 0
17 mol 265 unq 0 iso 0 dist 8.5774 8.80592 6.04835 8.70514 4.85294 7.7096 numMergedOcc 0
18 mol 265 unq 1 iso 0 dist 9.94957 14.366 6.04835 12.6819 4.85294 7.7096 numMergedOcc 0
19 mol 265 unq 2 iso 0 dist 8.01664 11.7178 6.04835 8.6462 4.85294 7.7096 numMergedOcc 0
