0 mol 1 unq 0 iso 0 dist 6.06669 9.25624 7.64327 12.2868 6.2936 9.69226 numMergedOcc 0
1 mol 1 unq 1 iso 0 dist 6.06669 5.84895 8.28595 12.2868 6.2936 12.841 numMergedOcc 0
2 mol 1 unq 2 iso 0 dist 6.06669 3.79575 9.31967 12.2868 6.2936 15.1985 numMergedOcc 0
3 mol 55 unq 0 iso 0 dist 4.70371 6.33835 8.57528 9.10397 9.89804 4.31691 numMergedOcc 0
4 mol 55 unq 1 iso 0 dist 4.70371 5.35556 8.24934 9.10397 9.89804 6.96815 numMergedOcc 0
5 mol 123 unq 0 iso 0 dist 7.76707 4.6327 7.99359 6.21476 9.04549 10.4757 numMergedOcc 0
6 mol 123 unq 1 iso 0 dist 7.63425 6.12041 7.99359 9.82161 9.04549 10.4757 numMergedOcc 0
7 mol 125 unq 0 iso 0 dist 4.81596 5.29844 6.31546 6.24872 7.00113 4.18419 numMergedOcc 0
8 mol 125 unq 1 iso 0 dist 4.81596 5.29844 6.31546 10.4668 9.85979 7.15048 numMergedOcc 0
9 mol 158 unq 0 iso 0 dist 6.45502 10.9769 8.6903 7.33177 8.07946 6.41051 numMergedOcc 0
10 mol 158 unq 1 iso 0 dist 8.66056 11.0962 8.6903 11.4363 8.07946 6.41051 numMergedOcc 0
11 mol 174 unq 0 iso 0 dist 5.11555 6.43119 8.46781 6.09052 9.31454 8.58274 numMergedOcc 0
12 mol 184 unq 0 iso 0 dist 9.0757 10.3615 8.11014 5.71349 4.88303 6.01155 numMergedOcc 0
13 mol 184 unq 1 iso 0 dist 9.39563 11.4233 8.11014 12.9618 4.88303 6.01155 numMergedOcc 0
14 mol 184 unq 2 iso 0 dist 7.51045 4.96558 8.11014 8.54538 4.88303 6.01155 numMergedOcc 0
15 mol 192 unq 0 iso 0 dist 5.99974 10.3962 8.43359 5.27811 7.37823 6.61047 numMergedOcc 0
16 mol 204 unq 0 iso 0 dist 7.5696 6.67496 7.30459 11.801 9.23676 7.68984 numMergedOcc 0
17 mol 204 unq 1 iso 0 dist 7.5696 6.81615 8.73423 11.801 9.23676 16.263 numMergedOcc 0
18 mol 239 unq 0 iso 0 dist 7.19924 9.3643 6.17408 5.93253 9.85821 12.4808 numMergedOcc 0
19 mol 239 unq 1 iso 0 dist 7.19924 9.47569 6.17602 5.93253 9.85821 13.9899 numMergedOcc 0
20 mol 241 unq 0 iso 0 dist 8.89382 5.07803 8.50897 10.0326 7.82708 6.46587 numMergedOcc 0
21 mol 241 unq 1 iso 0 dist 8.89382 10.9305 8.10031 10.0326 7.82708 4.27187 numMergedOcc 0
22 mol 247 unq 0 iso 0 dist 5.32075 5.03659 6.23164 6.25568 6.29945 4.46 numMergedOcc 0
23 mol 252 unq 0 iso 0 dist 9.31855 12.2252 8.85493 7.27483 7.60896 5.86715 numMergedOcc 0
24 mol 278 unq 0 iso 0 dist 9.48559 7.47959 9.79758 3.5882 8.30195 4.19643 numMergedOcc 0
25 mol 285 unq 0 iso 0 dist 4.09984 8.15057 7.85044 6.25741 9.26309 14.0883 numMergedOcc 0
