0 mol 26 unq 0 iso 0 dist 6.42206 9.08976 6.66387 3.63999 7.89667 10.343 numMergedOcc 0
1 mol 79 unq 0 iso 0 dist 9.04935 7.93317 9.59811 8.47393 7.06029 13.7564 numMergedOcc 0
2 mol 79 unq 1 iso 0 dist 9.04935 7.11013 11.9573 8.47393 7.06029 9.11491 numMergedOcc 0
3 mol 79 unq 2 iso 0 dist 9.04935 9.62096 13.9374 8.47393 7.06029 16.5992 numMergedOcc 0
4 mol 85 unq 0 iso 0 dist 9.66549 7.46478 16.1058 11.9486 9.86038 14.9504 numMergedOcc 0
5 mol 93 unq 0 iso 0 dist 8.84466 5.77804 12.5605 13.6305 5.10693 17.6028 numMergedOcc 0
6 mol 93 unq 1 iso 0 dist 8.84466 5.77804 12.5605 14.1431 6.58814 18.4528 numMergedOcc 0
7 mol 93 unq 2 iso 0 dist 8.84466 5.77804 12.5605 3.99275 6.13459 8.70794 numMergedOcc 0
8 mol 93 unq 3 iso 0 dist 8.84466 5.77804 12.5605 6.46195 7.54391 12.2186 numMergedOcc 0
9 mol 128 unq 0 iso 0 dist 9.35162 8.04178 8.80709 13.5215 8.46801 11.8453 numMergedOcc 0
10 mol 147 unq 0 iso 0 dist 6.28769 9.16053 5.81847 7.56825 8.76449 12.9545 numMergedOcc 0
11 mol 147 unq 1 iso 0 dist 6.28769 9.16053 5.81847 5.56838 8.36182 11.2486 numMergedOcc 0
12 mol 152 unq 0 iso 0 dist 8.30966 9.65224 13.0391 10.7623 9.28062 18.9762 numMergedOcc 0
13 mol 196 unq 0 iso 0 dist 5.76319 7.85296 4.55808 5.97525 6.10505 10.4167 numMergedOcc 0
14 mol 196 unq 1 iso 0 dist 5.30132 8.2841 4.55808 4.22321 6.10505 10.4167 numMergedOcc 0
15 mol 196 unq 2 iso 0 dist 8.36119 8.2424 4.55808 10.866 6.10505 10.4167 numMergedOcc 0
16 mol 259 unq 0 iso 0 dist 6.83706 5.68415 7.53102 3.94409 6.69951 5.23503 numMergedOcc 0
17 mol 265 unq 0 iso 0 dist 8.09021 7.74463 5.55314 3.5393 5.8898 8.03604 numMergedOcc 0
18 mol 265 unq 1 iso 0 dist 6.98451 5.88787 6.97049 3.99477 5.8898 5.94614 numMergedOcc 0
