0 mol 59 unq 0 iso 0 dist 6.47132 10.6275 6.48625 6.13703 6.56212 11.1377 numMergedOcc 0
1 mol 76 unq 0 iso 0 dist 9.79714 12.4461 6.83992 9.4173 8.13108 4.74638 numMergedOcc 0
2 mol 117 unq 0 iso 0 dist 8.98848 14.6332 9.85576 10.1153 8.84018 12.4378 numMergedOcc 0
3 mol 129 unq 0 iso 0 dist 6.1421 7.55004 6.29026 5.75588 5.51197 4.79473 numMergedOcc 0
4 mol 129 unq 1 iso 0 dist 6.1421 7.55004 6.29026 3.82645 6.69691 5.04019 numMergedOcc 0
5 mol 129 unq 2 iso 0 dist 6.1421 7.55004 6.29026 4.18263 8.86944 10.1802 numMergedOcc 0
6 mol 129 unq 3 iso 0 dist 9.54663 8.10347 6.29026 11.0564 5.51197 4.79473 numMergedOcc 0
7 mol 129 unq 4 iso 0 dist 9.54663 8.10347 6.29026 5.71616 6.69691 5.04019 numMergedOcc 0
8 mol 129 unq 5 iso 0 dist 9.54663 8.10347 6.29026 7.22602 8.86944 10.1802 numMergedOcc 0
9 mol 182 unq 0 iso 0 dist 7.21035 6.16006 7.86625 4.16926 9.56028 4.82437 numMergedOcc 0
10 mol 206 unq 0 iso 0 dist 6.18991 7.14522 9.38127 4.10207 9.21377 8.22172 numMergedOcc 0
11 mol 206 unq 1 iso 0 dist 6.18991 6.08627 6.97859 4.10207 9.21377 5.84459 numMergedOcc 0
12 mol 206 unq 2 iso 0 dist 8.68547 4.44813 9.38127 7.03848 9.21377 8.22172 numMergedOcc 0
13 mol 206 unq 3 iso 0 dist 8.68547 7.78218 6.97859 7.03848 9.21377 5.84459 numMergedOcc 0
14 mol 214 unq 0 iso 0 dist 9.33638 13.5629 8.49704 10.2403 7.46481 4.112 numMergedOcc 0
15 mol 236 unq 0 iso 0 dist 6.67907 10.4934 9.10613 7.15922 8.23087 4.8226 numMergedOcc 0
16 mol 257 unq 0 iso 0 dist 9.13483 4.43997 8.69184 6.16483 6.34915 6.70515 numMergedOcc 0
17 mol 257 unq 1 iso 0 dist 6.44188 4.43997 8.18901 6.16483 7.81897 6.70515 numMergedOcc 0
18 mol 257 unq 2 iso 0 dist 5.16581 3.72932 8.69184 5.48725 6.34915 6.70515 numMergedOcc 0
19 mol 257 unq 3 iso 0 dist 5.13633 3.72932 8.18901 5.48725 7.81897 6.70515 numMergedOcc 0
20 mol 257 unq 4 iso 0 dist 6.50405 5.42185 5.36776 9.94726 8.83833 11.9011 numMergedOcc 0
21 mol 259 unq 0 iso 0 dist 9.89728 16.8866 7.93997 13.7396 5.85442 7.06301 numMergedOcc 0
22 mol 259 unq 1 iso 0 dist 9.89728 16.8866 7.93997 15.7491 6.95511 7.80863 numMergedOcc 0
23 mol 276 unq 0 iso 0 dist 6.97104 12.6916 9.05218 9.98339 8.6759 5.58312 numMergedOcc 0
24 mol 276 unq 1 iso 0 dist 8.63281 11.5683 9.05218 7.37489 8.6759 5.58312 numMergedOcc 0
25 mol 277 unq 0 iso 0 dist 6.86014 9.93994 6.90434 11.4058 9.35539 8.51268 numMergedOcc 0
26 mol 277 unq 1 iso 0 dist 6.86014 9.93994 6.90434 14.6762 8.9682 13.3706 numMergedOcc 0
27 mol 277 unq 2 iso 0 dist 6.86014 9.93994 6.90434 11.68 6.92711 12.1739 numMergedOcc 0
28 mol 277 unq 3 iso 0 dist 5.97073 9.83255 6.90434 6.9003 9.35539 8.51268 numMergedOcc 0
29 mol 277 unq 4 iso 0 dist 5.97073 9.83255 6.90434 11.3103 8.9682 13.3706 numMergedOcc 0
30 mol 277 unq 5 iso 0 dist 5.97073 9.83255 6.90434 10.5734 6.92711 12.1739 numMergedOcc 0
31 mol 277 unq 6 iso 0 dist 8.23147 11.3539 9.02914 6.40883 5.46926 13.3706 numMergedOcc 0
32 mol 277 unq 7 iso 0 dist 8.23147 11.3539 9.02914 6.79352 5.13913 12.1739 numMergedOcc 0
33 mol 277 unq 8 iso 0 dist 6.49176 11.3539 6.90434 11.7592 9.35539 8.51268 numMergedOcc 0
34 mol 277 unq 9 iso 0 dist 6.49176 11.3539 6.90434 6.40883 8.9682 13.3706 numMergedOcc 0
35 mol 277 unq 10 iso 0 dist 6.49176 11.3539 6.90434 6.79352 6.92711 12.1739 numMergedOcc 0
36 mol 277 unq 11 iso 0 dist 5.22392 14.247 9.98528 6.68571 9.57499 19.5312 numMergedOcc 0
37 mol 277 unq 12 iso 0 dist 8.20217 13.4481 9.02914 6.68571 5.46926 13.3706 numMergedOcc 0
38 mol 277 unq 13 iso 0 dist 8.20217 13.4481 9.02914 9.44642 5.13913 12.1739 numMergedOcc 0
