0 mol 21 unq 0 iso 0 dist 7.48808 7.01513 7.08873 5.24786 7.88429 6.29808 numMergedOcc 0
1 mol 34 unq 0 iso 0 dist 8.36524 5.39587 4.55481 9.05146 8.16494 5.51172 numMergedOcc 0
2 mol 41 unq 0 iso 0 dist 5.36895 4.29713 7.18662 10.1173 13.076 6.64721 numMergedOcc 0
3 mol 41 unq 1 iso 0 dist 5.36895 4.29713 7.18662 11.2861 16.1016 9.36169 numMergedOcc 0
4 mol 51 unq 0 iso 0 dist 6.67213 8.92175 4.32726 5.44727 8.99612 9.07954 numMergedOcc 0
5 mol 55 unq 0 iso 0 dist 6.81152 8.3736 9.9157 7.39216 11.8978 5.69981 numMergedOcc 0
6 mol 55 unq 1 iso 0 dist 6.81152 8.3736 9.9157 14.1004 16.7127 9.873 numMergedOcc 0
7 mol 68 unq 0 iso 0 dist 5.9651 6.09085 7.50975 11.9238 10.6232 8.8014 numMergedOcc 0
8 mol 69 unq 0 iso 0 dist 8.29727 7.21134 11.6801 4.9038 12.0878 9.77648 numMergedOcc 0
9 mol 69 unq 1 iso 0 dist 8.29727 7.21134 11.6801 14.266 20.2419 9.18161 numMergedOcc 0
10 mol 89 unq 0 iso 0 dist 8.85873 7.02228 6.13636 5.19804 5.25504 5.65453 numMergedOcc 0
11 mol 89 unq 1 iso 0 dist 7.3606 7.02228 4.16955 5.19804 7.84991 5.65453 numMergedOcc 0
12 mol 134 unq 0 iso 0 dist 9.42271 6.14652 12.3479 5.57798 14.18 9.8564 numMergedOcc 0
13 mol 186 unq 0 iso 0 dist 6.0639 8.95209 11.6282 10.6164 14.0754 5.00402 numMergedOcc 0
14 mol 186 unq 1 iso 0 dist 6.91355 8.95209 10.5033 10.6164 14.5017 5.00402 numMergedOcc 0
15 mol 206 unq 0 iso 0 dist 5.82039 9.36144 7.89575 13.707 16.0098 9.7713 numMergedOcc 0
16 mol 206 unq 1 iso 0 dist 6.22964 9.36144 5.14674 13.707 10.2444 9.7713 numMergedOcc 0
17 mol 232 unq 0 iso 0 dist 7.57253 8.1692 5.42461 9.48135 12.6389 8.22129 numMergedOcc 0
18 mol 243 unq 0 iso 0 dist 7.80612 9.89379 4.81639 4.72507 4.89168 8.92798 numMergedOcc 0
