0 mol 10 unq 0 iso 0 dist 7.99404 3.5691 6.68744 8.95503 5.30796 6.50154 numMergedOcc 0
1 mol 20 unq 0 iso 0 dist 9.35248 3.63394 8.38129 10.0174 5.48326 8.19827 numMergedOcc 0
2 mol 20 unq 1 iso 0 dist 9.55415 5.17224 8.38129 10.3199 5.48326 8.19827 numMergedOcc 0
3 mol 88 unq 0 iso 0 dist 9.4046 3.48087 9.27633 6.98838 6.64721 6.1847 numMergedOcc 0
4 mol 92 unq 0 iso 0 dist 9.93688 14.5838 7.36335 11.2639 6.12826 5.32369 numMergedOcc 0
5 mol 92 unq 1 iso 0 dist 9.93688 14.5838 7.36335 7.57958 5.02124 7.03417 numMergedOcc 0
6 mol 92 unq 2 iso 0 dist 9.88184 16.6198 7.36335 14.5144 6.12826 5.32369 numMergedOcc 0
7 mol 92 unq 3 iso 0 dist 9.88184 16.6198 7.36335 10.8442 5.02124 7.03417 numMergedOcc 0
8 mol 131 unq 0 iso 0 dist 8.89412 5.78374 6.94015 12.5712 5.53162 9.24546 numMergedOcc 0
9 mol 141 unq 0 iso 0 dist 6.95914 15.8449 9.80185 17.3182 10.3678 6.50336 numMergedOcc 0
10 mol 147 unq 0 iso 0 dist 5.82034 10.5092 8.62135 16.4854 11.92 9.23589 numMergedOcc 0
11 mol 147 unq 1 iso 0 dist 6.56854 9.7319 8.62135 16.772 11.92 9.23589 numMergedOcc 0
12 mol 181 unq 0 iso 0 dist 6.13872 3.55808 6.19329 5.41368 4.97806 7.61421 numMergedOcc 0
13 mol 197 unq 0 iso 0 dist 5.79753 3.70636 7.06868 10.7619 10.1284 9.77656 numMergedOcc 0
14 mol 197 unq 1 iso 0 dist 7.56537 8.82321 7.06868 9.62514 10.1284 9.77656 numMergedOcc 0
15 mol 205 unq 0 iso 0 dist 9.32657 15.4907 9.88692 14.6687 6.96766 9.81165 numMergedOcc 0
16 mol 205 unq 1 iso 0 dist 9.32657 11.6653 9.38368 14.6687 6.96766 7.8423 numMergedOcc 0
17 mol 205 unq 2 iso 0 dist 6.21409 11.6653 9.29298 14.6687 9.95664 7.8423 numMergedOcc 0
18 mol 234 unq 0 iso 0 dist 6.56262 11.4672 9.8226 10.6033 6.14528 5.69634 numMergedOcc 0
19 mol 234 unq 1 iso 0 dist 6.56262 11.4672 9.8226 15.8952 11.1481 7.91374 numMergedOcc 0
20 mol 234 unq 2 iso 0 dist 6.56262 11.4672 9.8226 15.8037 11.0167 7.35086 numMergedOcc 0
21 mol 234 unq 3 iso 0 dist 6.56262 11.4672 9.8226 17.1235 15.0842 6.81195 numMergedOcc 0
22 mol 234 unq 4 iso 0 dist 8.38742 9.98235 9.2653 10.9014 5.43106 5.69634 numMergedOcc 0
23 mol 234 unq 5 iso 0 dist 8.38742 9.98235 9.2653 11.8024 6.41546 7.91374 numMergedOcc 0
24 mol 234 unq 6 iso 0 dist 8.38742 9.98235 9.2653 7.19662 4.69096 7.35086 numMergedOcc 0
25 mol 234 unq 7 iso 0 dist 8.38742 9.98235 9.2653 14.5897 12.788 6.81195 numMergedOcc 0
26 mol 259 unq 0 iso 0 dist 7.97113 9.58753 8.75224 10.5745 11.3446 5.23503 numMergedOcc 0
27 mol 259 unq 1 iso 0 dist 7.97113 9.58753 8.75224 8.46351 11.1732 9.61028 numMergedOcc 0
28 mol 259 unq 2 iso 0 dist 8.38479 6.78897 8.75224 9.9591 11.3446 5.23503 numMergedOcc 0
29 mol 259 unq 3 iso 0 dist 8.38479 6.78897 8.75224 10.9956 11.1732 9.61028 numMergedOcc 0
30 mol 265 unq 0 iso 0 dist 6.98812 13.0312 6.80043 17.0427 10.3184 8.03604 numMergedOcc 0
31 mol 265 unq 1 iso 0 dist 6.98812 13.0312 6.80043 10.322 4.98228 5.94614 numMergedOcc 0
32 mol 277 unq 0 iso 0 dist 8.00159 4.20802 8.04081 12.2739 13.0233 8.13595 numMergedOcc 0
33 mol 283 unq 0 iso 0 dist 8.80555 13.6006 8.91437 18.4403 10.4634 7.83424 numMergedOcc 0
34 mol 283 unq 1 iso 0 dist 8.80418 6.35533 8.91437 11.5064 10.4634 7.83424 numMergedOcc 0
35 mol 292 unq 0 iso 0 dist 8.92332 12.4675 7.89784 14.2121 7.32101 3.93401 numMergedOcc 0
