0 mol 30 unq 0 iso 0 dist 9.50224 9.72515 4.32449 4.07703 8.20049 9.46036 numMergedOcc 0
1 mol 63 unq 0 iso 0 dist 9.22609 7.76044 9.23649 6.11728 14.1208 7.89201 numMergedOcc 0
2 mol 91 unq 0 iso 0 dist 9.52936 9.77304 16.1045 4.23182 7.62621 9.83906 numMergedOcc 0
3 mol 100 unq 0 iso 0 dist 8.55624 6.98876 5.36674 6.08419 11.5129 6.97361 numMergedOcc 0
4 mol 108 unq 0 iso 0 dist 9.81705 8.49918 13.0702 7.15661 15.5632 6.46069 numMergedOcc 0
5 mol 108 unq 1 iso 0 dist 9.81705 6.29966 5.53449 7.65804 10.9542 5.52402 numMergedOcc 0
6 mol 108 unq 2 iso 0 dist 9.81705 6.29966 5.53449 9.35984 8.89997 6.79804 numMergedOcc 0
7 mol 108 unq 3 iso 0 dist 6.32309 8.49918 13.816 7.15661 11.916 6.46069 numMergedOcc 0
8 mol 108 unq 4 iso 0 dist 6.32309 9.31725 5.53449 14.3699 10.9542 5.52402 numMergedOcc 0
9 mol 108 unq 5 iso 0 dist 6.32309 9.31725 5.53449 11.9597 8.89997 6.79804 numMergedOcc 0
10 mol 108 unq 6 iso 0 dist 8.60437 8.49918 16.0071 7.15661 15.3145 6.46069 numMergedOcc 0
11 mol 108 unq 7 iso 0 dist 8.60437 9.57358 5.53449 13.8903 10.9542 5.52402 numMergedOcc 0
12 mol 108 unq 8 iso 0 dist 8.60437 9.57358 5.53449 13.7036 8.89997 6.79804 numMergedOcc 0
13 mol 108 unq 9 iso 0 dist 5.8711 8.84888 9.65124 15.0248 18.4644 9.82453 numMergedOcc 0
14 mol 108 unq 10 iso 0 dist 5.8711 5.38329 6.97518 4.85222 8.69068 5.52402 numMergedOcc 0
15 mol 108 unq 11 iso 0 dist 5.8711 5.38329 6.97518 10.7411 13.5097 6.79804 numMergedOcc 0
16 mol 108 unq 12 iso 0 dist 5.8711 7.62421 4.62224 4.85222 8.69068 7.57593 numMergedOcc 0
17 mol 124 unq 0 iso 0 dist 7.24083 5.69775 9.35084 3.89739 8.48985 7.83509 numMergedOcc 0
18 mol 151 unq 0 iso 0 dist 8.1034 8.96469 9.10018 4.20596 8.25396 9.74969 numMergedOcc 0
19 mol 153 unq 0 iso 0 dist 8.92147 9.6083 4.7182 4.20904 5.9974 5.44883 numMergedOcc 0
20 mol 196 unq 0 iso 0 dist 9.67795 6.51568 12.7242 9.19308 18.2412 7.42783 numMergedOcc 0
21 mol 283 unq 0 iso 0 dist 9.74822 5.78449 5.08363 3.85698 13.2153 8.80555 numMergedOcc 0
22 mol 283 unq 1 iso 0 dist 9.74822 5.78449 5.08363 7.85589 8.28068 8.80418 numMergedOcc 0
23 mol 294 unq 0 iso 0 dist 8.63523 8.34193 9.73381 9.20989 11.4664 6.42303 numMergedOcc 0
24 mol 294 unq 1 iso 0 dist 8.63523 8.35722 14.2745 9.32276 13.8444 5.27236 numMergedOcc 0
