0 mol 21 unq 0 iso 0 dist 9.19322 10.5082 8.07914 14.7812 7.30688 10.1117 numMergedOcc 0
1 mol 21 unq 1 iso 0 dist 9.19322 10.5082 8.07914 6.37687 6.70786 9.53082 numMergedOcc 0
2 mol 21 unq 2 iso 0 dist 9.19322 10.5082 8.07914 9.29021 8.16395 9.20888 numMergedOcc 0
3 mol 71 unq 0 iso 0 dist 9.3877 12.1458 8.92529 5.26906 7.50921 7.78799 numMergedOcc 0
4 mol 129 unq 0 iso 0 dist 7.28273 9.054 7.6453 10.0627 9.31543 9.82512 numMergedOcc 0
5 mol 129 unq 1 iso 0 dist 7.28273 9.054 7.6453 11.8027 8.85652 6.31483 numMergedOcc 0
6 mol 132 unq 0 iso 0 dist 5.52837 4.8602 9.39389 4.78213 8.62632 7.69707 numMergedOcc 0
7 mol 133 unq 0 iso 0 dist 8.72732 8.09812 9.2759 5.25744 5.9959 4.85121 numMergedOcc 0
8 mol 192 unq 0 iso 0 dist 9.37214 6.63652 9.69055 4.77116 9.63224 5.41626 numMergedOcc 0
9 mol 192 unq 1 iso 0 dist 9.37214 6.63652 9.69055 4.65378 6.98794 3.98653 numMergedOcc 0
10 mol 195 unq 0 iso 0 dist 8.5734 6.01671 5.61326 10.1093 7.75518 4.3166 numMergedOcc 0
11 mol 198 unq 0 iso 0 dist 8.73074 15.3415 9.87574 13.3819 7.7619 4.58443 numMergedOcc 0
12 mol 204 unq 0 iso 0 dist 7.24135 8.49394 9.38188 3.72487 6.63935 6.37117 numMergedOcc 0
13 mol 204 unq 1 iso 0 dist 7.30459 8.3119 6.20044 3.93117 5.81438 7.35194 numMergedOcc 0
14 mol 204 unq 2 iso 0 dist 7.30459 4.008 8.41232 3.93117 5.81438 5.87202 numMergedOcc 0
15 mol 204 unq 3 iso 0 dist 8.73423 13.884 6.20044 11.1412 5.81438 7.35194 numMergedOcc 0
16 mol 204 unq 4 iso 0 dist 8.73423 12.8942 8.41232 11.1412 5.81438 5.87202 numMergedOcc 0
17 mol 214 unq 0 iso 0 dist 7.74406 8.42395 5.86911 7.96442 8.44407 4.54444 numMergedOcc 0
18 mol 214 unq 1 iso 0 dist 7.74406 8.42395 5.86911 3.87538 6.0155 7.05353 numMergedOcc 0
19 mol 214 unq 2 iso 0 dist 7.74406 8.42395 5.86911 11.5715 8.89981 12.9344 numMergedOcc 0
20 mol 214 unq 3 iso 0 dist 7.74406 3.97644 7.89258 7.96442 8.44407 5.33718 numMergedOcc 0
21 mol 214 unq 4 iso 0 dist 7.74406 3.97644 7.89258 3.87538 6.0155 5.12324 numMergedOcc 0
22 mol 214 unq 5 iso 0 dist 7.74406 3.97644 7.89258 11.5715 8.89981 12.8738 numMergedOcc 0
23 mol 223 unq 0 iso 0 dist 9.10041 10.9692 6.97426 10.8541 7.5808 9.46802 numMergedOcc 0
24 mol 223 unq 1 iso 0 dist 9.10041 10.2498 8.87456 10.8541 7.5808 13.1129 numMergedOcc 0
25 mol 255 unq 0 iso 0 dist 5.84157 4.52659 7.57779 4.04928 7.58813 8.06922 numMergedOcc 0
26 mol 258 unq 0 iso 0 dist 8.88518 14.5913 8.10903 9.29502 9.6327 8.78474 numMergedOcc 0
27 mol 258 unq 1 iso 0 dist 8.88518 14.3641 7.25618 9.29502 9.6327 11.3267 numMergedOcc 0
28 mol 258 unq 2 iso 0 dist 9.44669 12.0868 9.48772 14.2548 9.81589 9.73819 numMergedOcc 0
29 mol 258 unq 3 iso 0 dist 9.44669 5.60485 5.53369 14.2548 9.81589 8.86983 numMergedOcc 0
30 mol 258 unq 4 iso 0 dist 9.44669 4.22701 8.57274 14.2548 9.81589 15.1125 numMergedOcc 0
31 mol 266 unq 0 iso 0 dist 7.07099 4.19938 6.57444 13.8362 8.95841 10.6488 numMergedOcc 0
32 mol 266 unq 1 iso 0 dist 7.07099 8.95939 7.9555 13.8362 8.95841 9.70494 numMergedOcc 0
33 mol 280 unq 0 iso 0 dist 7.60676 7.87626 4.45141 9.85019 7.4869 4.06908 numMergedOcc 0
34 mol 287 unq 0 iso 0 dist 9.04355 5.05806 6.96774 8.83056 7.19568 3.85958 numMergedOcc 0
35 mol 287 unq 1 iso 0 dist 9.04355 11.1974 7.14859 8.83056 7.19568 5.93557 numMergedOcc 0
36 mol 288 unq 0 iso 0 dist 9.04355 5.05806 6.96774 8.83056 7.19568 3.85958 numMergedOcc 0
37 mol 288 unq 1 iso 0 dist 9.04355 11.1974 7.14859 8.83056 7.19568 5.93557 numMergedOcc 0
38 mol 289 unq 0 iso 0 dist 9.04355 5.05806 6.96774 8.83056 7.19568 3.85958 numMergedOcc 0
39 mol 289 unq 1 iso 0 dist 9.04355 11.1974 7.14859 8.83056 7.19568 5.93557 numMergedOcc 0
