0 mol 15 unq 0 iso 0 dist 9.29358 6.91314 9.51568 5.89412 6.19131 6.23015 numMergedOcc 0
1 mol 26 unq 0 iso 0 dist 8.82012 5.56139 5.84066 6.46104 4.98603 6.07276 numMergedOcc 0
2 mol 26 unq 1 iso 0 dist 9.16962 8.25132 5.84066 10.177 4.98603 6.07276 numMergedOcc 0
3 mol 26 unq 2 iso 0 dist 6.73162 7.11305 9.96121 11.9684 10.8434 6.81793 numMergedOcc 0
4 mol 27 unq 0 iso 0 dist 9.77484 9.11842 6.78936 12.1411 4.39306 5.9635 numMergedOcc 0
5 mol 58 unq 0 iso 0 dist 9.33535 9.53718 7.03126 18.0116 11.6859 9.02642 numMergedOcc 0
6 mol 58 unq 1 iso 0 dist 8.26899 5.61579 7.03126 14.2075 11.6859 9.02642 numMergedOcc 0
7 mol 72 unq 0 iso 0 dist 8.624 3.94376 5.4605 11.1896 4.67641 7.58875 numMergedOcc 0
8 mol 72 unq 1 iso 0 dist 8.624 6.19288 6.53824 11.1896 4.67641 6.91169 numMergedOcc 0
9 mol 72 unq 2 iso 0 dist 6.77912 5.69391 5.4605 9.27838 4.67641 7.58875 numMergedOcc 0
10 mol 72 unq 3 iso 0 dist 6.77912 4.03844 6.53824 9.27838 4.67641 6.91169 numMergedOcc 0
11 mol 119 unq 0 iso 0 dist 7.39889 14.443 9.08536 21.8836 15.4934 8.67537 numMergedOcc 0
12 mol 119 unq 1 iso 0 dist 9.63176 9.68677 9.08536 17.8739 15.4934 8.67537 numMergedOcc 0
13 mol 119 unq 2 iso 0 dist 6.19042 6.20019 6.13374 11.5311 7.39626 8.67537 numMergedOcc 0
14 mol 119 unq 3 iso 0 dist 7.44174 6.20019 9.08536 11.5311 15.4934 8.67537 numMergedOcc 0
15 mol 119 unq 4 iso 0 dist 8.43904 4.39676 6.13374 6.73586 7.39626 8.67537 numMergedOcc 0
16 mol 155 unq 0 iso 0 dist 9.38946 4.91785 7.29911 7.92304 9.50478 9.16358 numMergedOcc 0
17 mol 155 unq 1 iso 0 dist 9.38946 4.91785 7.29911 10.3161 12.0574 9.24038 numMergedOcc 0
18 mol 155 unq 2 iso 0 dist 7.39644 7.10286 5.36254 11.1616 5.50045 9.16358 numMergedOcc 0
19 mol 155 unq 3 iso 0 dist 7.39644 7.10286 5.36254 6.53347 6.40403 9.24038 numMergedOcc 0
20 mol 155 unq 4 iso 0 dist 7.36102 4.91785 5.36254 7.92304 5.50045 9.16358 numMergedOcc 0
21 mol 155 unq 5 iso 0 dist 7.36102 4.91785 5.36254 10.3161 6.40403 9.24038 numMergedOcc 0
22 mol 181 unq 0 iso 0 dist 4.93785 6.8757 9.09234 10.4943 11.5017 8.12266 numMergedOcc 0
23 mol 181 unq 1 iso 0 dist 4.93785 5.71898 6.76746 9.39829 7.30555 5.99437 numMergedOcc 0
24 mol 181 unq 2 iso 0 dist 4.93785 5.83796 8.92098 10.4943 11.5017 9.43306 numMergedOcc 0
25 mol 181 unq 3 iso 0 dist 4.93785 5.83796 8.92098 9.39829 7.30555 8.4848 numMergedOcc 0
26 mol 182 unq 0 iso 0 dist 6.73313 4.88992 5.73635 6.73956 5.8726 8.62102 numMergedOcc 0
27 mol 194 unq 0 iso 0 dist 5.48258 4.66791 7.10155 6.72379 4.26755 9.00322 numMergedOcc 0
28 mol 194 unq 1 iso 0 dist 5.48258 5.97754 6.11135 9.69399 4.34256 9.32959 numMergedOcc 0
29 mol 194 unq 2 iso 0 dist 5.48258 5.97754 6.11135 8.29382 4.79043 8.64056 numMergedOcc 0
30 mol 194 unq 3 iso 0 dist 6.15769 5.97754 6.54481 9.69399 11.2817 9.32959 numMergedOcc 0
31 mol 194 unq 4 iso 0 dist 6.15769 5.97754 6.54481 8.29382 6.56076 8.64056 numMergedOcc 0
32 mol 195 unq 0 iso 0 dist 8.36117 6.04871 5.87439 9.26504 4.4994 6.22742 numMergedOcc 0
33 mol 195 unq 1 iso 0 dist 6.77578 6.04871 8.18059 9.26504 5.99784 6.22742 numMergedOcc 0
34 mol 218 unq 0 iso 0 dist 9.50586 13.7327 9.59426 15.592 6.53543 8.57119 numMergedOcc 0
35 mol 218 unq 1 iso 0 dist 7.17547 15.6802 8.61306 15.0011 9.52657 8.57119 numMergedOcc 0
36 mol 218 unq 2 iso 0 dist 7.13323 13.7327 8.61306 15.592 9.52657 8.57119 numMergedOcc 0
37 mol 224 unq 0 iso 0 dist 8.19953 5.13732 5.73591 10.0553 6.957 5.05368 numMergedOcc 0
38 mol 234 unq 0 iso 0 dist 6.16063 13.1872 9.11572 7.32499 7.17691 7.77911 numMergedOcc 0
39 mol 267 unq 0 iso 0 dist 8.76007 9.22276 5.08174 15.3399 10.0939 6.27154 numMergedOcc 0
40 mol 274 unq 0 iso 0 dist 9.19234 8.87855 6.66172 9.45514 12.625 9.65868 numMergedOcc 0
41 mol 274 unq 1 iso 0 dist 9.19234 8.87855 6.66172 6.39866 4.60275 8.60027 numMergedOcc 0
