0 mol 15 unq 0 iso 0 dist 5.72359 6.16313 8.111 6.32451 8.60614 10.7396 numMergedOcc 0
1 mol 15 unq 1 iso 0 dist 6.26048 5.68513 8.111 5.37184 8.60614 10.7396 numMergedOcc 0
2 mol 21 unq 0 iso 0 dist 7.46409 13.0943 5.93898 4.09637 6.28263 10.6971 numMergedOcc 0
3 mol 24 unq 0 iso 0 dist 6.40189 10.212 8.87744 4.98286 4.5711 6.38336 numMergedOcc 0
4 mol 24 unq 1 iso 0 dist 5.22014 10.212 7.27472 4.98286 4.44526 6.38336 numMergedOcc 0
5 mol 24 unq 2 iso 0 dist 5.22014 10.212 7.27472 12.988 9.586 6.7828 numMergedOcc 0
6 mol 25 unq 0 iso 0 dist 8.26412 8.64255 7.6114 4.93307 6.29797 5.68392 numMergedOcc 0
7 mol 58 unq 0 iso 0 dist 6.86485 7.71984 9.22598 4.7391 9.01564 9.95364 numMergedOcc 0
8 mol 58 unq 1 iso 0 dist 6.86485 4.67517 8.96727 4.7391 9.01564 5.49591 numMergedOcc 0
9 mol 58 unq 2 iso 0 dist 8.37546 4.67517 8.01308 4.7391 7.11065 5.49591 numMergedOcc 0
10 mol 58 unq 3 iso 0 dist 9.76234 12.5529 9.22598 4.35705 9.01564 9.95364 numMergedOcc 0
11 mol 58 unq 4 iso 0 dist 9.76234 8.47822 8.96727 4.35705 9.01564 5.49591 numMergedOcc 0
12 mol 76 unq 0 iso 0 dist 8.25047 6.4988 8.23026 12.1829 8.77077 6.5901 numMergedOcc 0
13 mol 92 unq 0 iso 0 dist 9.61144 14.8146 9.36001 5.60623 6.59716 13.9524 numMergedOcc 0
14 mol 92 unq 1 iso 0 dist 6.13521 4.78289 7.06939 5.60623 6.87506 9.44576 numMergedOcc 0
15 mol 98 unq 0 iso 0 dist 5.44426 9.04817 5.10496 14.3798 9.84703 7.94178 numMergedOcc 0
16 mol 98 unq 1 iso 0 dist 5.44426 9.04817 5.10496 9.0917 4.62494 4.4057 numMergedOcc 0
17 mol 98 unq 2 iso 0 dist 5.44426 4.70157 5.92242 14.3798 9.84703 15.7178 numMergedOcc 0
18 mol 98 unq 3 iso 0 dist 5.44426 4.70157 5.92242 9.0917 4.62494 7.42446 numMergedOcc 0
19 mol 98 unq 4 iso 0 dist 5.44426 6.21302 5.2571 14.3798 9.84703 9.85543 numMergedOcc 0
20 mol 98 unq 5 iso 0 dist 5.44426 6.21302 5.2571 9.0917 4.62494 9.67482 numMergedOcc 0
21 mol 98 unq 6 iso 0 dist 5.44426 11.2075 8.7497 14.3798 9.84703 7.28361 numMergedOcc 0
22 mol 98 unq 7 iso 0 dist 5.44426 11.2075 8.7497 9.0917 4.62494 12.0974 numMergedOcc 0
23 mol 98 unq 8 iso 0 dist 8.65429 8.35877 9.64383 14.1628 9.25444 18.5442 numMergedOcc 0
24 mol 98 unq 9 iso 0 dist 8.65429 8.35877 9.64383 16.4829 8.46823 16.4267 numMergedOcc 0
25 mol 98 unq 10 iso 0 dist 8.65429 9.9123 7.54889 14.1628 9.25444 9.85543 numMergedOcc 0
26 mol 98 unq 11 iso 0 dist 8.65429 9.9123 7.54889 16.4829 8.46823 9.67482 numMergedOcc 0
27 mol 98 unq 12 iso 0 dist 8.65429 8.49566 7.78931 14.1628 9.25444 7.28361 numMergedOcc 0
28 mol 98 unq 13 iso 0 dist 8.65429 8.49566 7.78931 16.4829 8.46823 12.0974 numMergedOcc 0
29 mol 105 unq 0 iso 0 dist 9.84347 8.40852 9.16718 14.1459 7.77089 11.0132 numMergedOcc 0
30 mol 105 unq 1 iso 0 dist 9.84347 4.7574 7.94633 14.1459 7.77089 9.96719 numMergedOcc 0
31 mol 129 unq 0 iso 0 dist 8.62413 5.57978 5.51197 6.02377 6.34626 4.92472 numMergedOcc 0
32 mol 133 unq 0 iso 0 dist 7.33743 6.80087 8.77023 8.11294 8.83732 4.54648 numMergedOcc 0
33 mol 141 unq 0 iso 0 dist 4.54218 10.5394 8.07097 4.37003 5.92302 10.1386 numMergedOcc 0
34 mol 141 unq 1 iso 0 dist 4.54218 10.5394 8.07097 4.34943 5.29898 7.42649 numMergedOcc 0
35 mol 141 unq 2 iso 0 dist 8.36316 11.2797 8.07097 9.86195 5.92302 10.1386 numMergedOcc 0
36 mol 141 unq 3 iso 0 dist 8.36316 11.2797 8.07097 4.50791 5.29898 7.42649 numMergedOcc 0
37 mol 181 unq 0 iso 0 dist 7.83476 5.49497 6.64173 4.19412 8.12266 5.63555 numMergedOcc 0
38 mol 186 unq 0 iso 0 dist 8.28282 11.3614 7.2793 5.39899 6.88127 10.5063 numMergedOcc 0
39 mol 222 unq 0 iso 0 dist 8.79662 13.3218 7.48954 10.4451 8.23406 7.75656 numMergedOcc 0
40 mol 235 unq 0 iso 0 dist 9.42801 15.4299 8.19317 11.4437 8.97952 6.82855 numMergedOcc 0
41 mol 235 unq 1 iso 0 dist 9.42801 10.8094 5.1823 11.4437 8.97952 6.46722 numMergedOcc 0
42 mol 273 unq 0 iso 0 dist 7.05843 6.95085 6.31969 5.91547 5.61969 7.81483 numMergedOcc 0
43 mol 273 unq 1 iso 0 dist 7.05843 6.95085 6.31969 5.8152 9.0277 7.92179 numMergedOcc 0
