0 mol 46 unq 0 iso 0 dist 8.37969 6.09371 8.2513 4.32471 9.77553 10.0786 numMergedOcc 0
1 mol 51 unq 0 iso 0 dist 5.67627 7.59524 7.7625 5.46557 7.12423 9.10817 numMergedOcc 0
2 mol 61 unq 0 iso 0 dist 8.46313 14.77 9.99643 3.88133 7.52103 11.5723 numMergedOcc 0
3 mol 61 unq 1 iso 0 dist 8.46313 14.77 9.99643 12.1397 8.46556 3.60123 numMergedOcc 0
4 mol 76 unq 0 iso 0 dist 7.24378 13.8345 8.28737 11.8144 8.58841 5.37389 numMergedOcc 0
5 mol 78 unq 0 iso 0 dist 8.40871 15.2043 7.80757 11.8939 9.23023 10.928 numMergedOcc 0
6 mol 78 unq 1 iso 0 dist 8.40871 6.23394 9.2835 11.8939 9.23023 7.59211 numMergedOcc 0
7 mol 78 unq 2 iso 0 dist 8.40871 7.51473 5.02591 11.8939 9.23023 5.13304 numMergedOcc 0
8 mol 176 unq 0 iso 0 dist 9.84636 6.38251 4.96326 15.867 7.30954 12.148 numMergedOcc 0
9 mol 176 unq 1 iso 0 dist 9.84636 11.9231 9.09976 15.867 7.30954 12.0324 numMergedOcc 0
10 mol 176 unq 2 iso 0 dist 9.84636 11.3704 9.73567 15.867 7.30954 10.5247 numMergedOcc 0
11 mol 196 unq 0 iso 0 dist 9.29791 7.39393 6.60651 8.04287 6.25429 4.73252 numMergedOcc 0
12 mol 197 unq 0 iso 0 dist 7.18765 9.84251 6.22696 14.6497 8.3337 6.19883 numMergedOcc 0
13 mol 214 unq 0 iso 0 dist 9.33638 15.8062 6.83122 16.7561 9.51764 6.06185 numMergedOcc 0
14 mol 214 unq 1 iso 0 dist 9.33638 15.8062 6.83122 5.24733 5.36829 12.1024 numMergedOcc 0
15 mol 238 unq 0 iso 0 dist 9.94587 13.6648 9.82174 5.6925 6.24928 11.6082 numMergedOcc 0
16 mol 249 unq 0 iso 0 dist 9.14351 4.20982 6.42827 8.05633 6.37672 7.26569 numMergedOcc 0
17 mol 249 unq 1 iso 0 dist 9.14351 4.20982 6.42827 6.09778 8.94023 6.09915 numMergedOcc 0
18 mol 253 unq 0 iso 0 dist 9.75753 15.0104 5.76077 12.1288 5.89502 5.03278 numMergedOcc 0
19 mol 253 unq 1 iso 0 dist 9.75753 15.0104 5.76077 15.7857 7.15815 4.58695 numMergedOcc 0
20 mol 253 unq 2 iso 0 dist 9.75753 10.5007 7.0247 12.1288 5.89502 12.6079 numMergedOcc 0
21 mol 253 unq 3 iso 0 dist 9.75753 10.5007 7.0247 15.7857 7.15815 11.088 numMergedOcc 0
22 mol 259 unq 0 iso 0 dist 9.89728 16.8784 9.47382 18.6806 9.54857 12.8939 numMergedOcc 0
23 mol 279 unq 0 iso 0 dist 9.60619 17.3271 8.27977 15.5414 7.74162 4.0145 numMergedOcc 0
24 mol 292 unq 0 iso 0 dist 7.29148 4.70797 6.8133 4.34283 9.6898 9.02523 numMergedOcc 0
25 mol 292 unq 1 iso 0 dist 7.29148 4.70797 6.8133 11.1098 5.75596 9.57206 numMergedOcc 0
26 mol 292 unq 2 iso 0 dist 6.87804 5.50967 5.69465 12.1872 9.20416 7.13877 numMergedOcc 0
27 mol 292 unq 3 iso 0 dist 6.87804 5.50967 5.69465 12.2904 7.53641 10.9754 numMergedOcc 0
28 mol 292 unq 4 iso 0 dist 6.07571 11.1934 5.69465 11.4534 9.20416 7.13877 numMergedOcc 0
29 mol 292 unq 5 iso 0 dist 6.07571 11.1934 5.69465 4.49811 7.53641 10.9754 numMergedOcc 0
