0 mol 0 unq 0 iso 0 dist 9.23213 7.40865 9.30151 10.3034 6.3267 12.9702 numMergedOcc 0
1 mol 8 unq 0 iso 0 dist 8.33604 8.53529 11.4716 4.85329 6.26865 11.4415 numMergedOcc 0
2 mol 9 unq 0 iso 0 dist 6.85412 9.62394 4.45625 5.60154 9.29529 9.57198 numMergedOcc 0
3 mol 9 unq 1 iso 0 dist 6.33889 9.62394 6.0397 5.60154 7.2199 9.57198 numMergedOcc 0
4 mol 9 unq 2 iso 0 dist 6.33889 9.62394 6.0397 4.61049 6.9513 12.164 numMergedOcc 0
5 mol 9 unq 3 iso 0 dist 6.33889 9.62394 6.0397 6.64015 9.16116 14.1469 numMergedOcc 0
6 mol 9 unq 4 iso 0 dist 6.33889 9.62394 6.0397 13.7377 8.47109 10.1029 numMergedOcc 0
7 mol 11 unq 0 iso 0 dist 9.53002 4.30695 11.9464 7.85924 5.43238 11.7385 numMergedOcc 0
8 mol 11 unq 1 iso 0 dist 9.53002 6.35398 7.5901 7.85924 5.43238 9.09091 numMergedOcc 0
9 mol 15 unq 0 iso 0 dist 8.21493 7.07399 6.33828 5.01321 8.96967 10.7313 numMergedOcc 0
10 mol 32 unq 0 iso 0 dist 8.68559 7.99969 7.14527 7.93694 7.18766 11.9741 numMergedOcc 0
11 mol 32 unq 1 iso 0 dist 8.68559 7.99969 7.14527 6.68431 7.48825 4.62858 numMergedOcc 0
12 mol 45 unq 0 iso 0 dist 9.43442 9.53378 8.70414 5.54436 8.59109 5.55096 numMergedOcc 0
13 mol 58 unq 0 iso 0 dist 8.26899 7.21955 10.8421 6.75888 8.80108 8.71468 numMergedOcc 0
14 mol 58 unq 1 iso 0 dist 9.58673 8.80614 8.88332 6.47744 7.01363 9.11258 numMergedOcc 0
15 mol 58 unq 2 iso 0 dist 8.63333 9.92355 12.0055 10.6476 6.96494 17.9037 numMergedOcc 0
16 mol 58 unq 3 iso 0 dist 8.63333 9.92355 12.0055 5.92889 7.01363 13.7654 numMergedOcc 0
17 mol 58 unq 4 iso 0 dist 8.89374 7.68678 12.0055 12.7331 6.96494 17.9037 numMergedOcc 0
18 mol 58 unq 5 iso 0 dist 8.89374 7.68678 12.0055 7.05413 7.01363 13.7654 numMergedOcc 0
19 mol 59 unq 0 iso 0 dist 8.24062 6.73347 7.0313 5.33688 6.5096 9.2902 numMergedOcc 0
20 mol 72 unq 0 iso 0 dist 6.77912 9.27838 4.67641 9.0131 9.19459 13.1462 numMergedOcc 0
21 mol 114 unq 0 iso 0 dist 8.71128 6.84011 9.23527 9.2907 7.36816 10.1333 numMergedOcc 0
22 mol 155 unq 0 iso 0 dist 9.87281 8.69157 7.6506 5.48883 6.51096 9.0529 numMergedOcc 0
23 mol 155 unq 1 iso 0 dist 7.39644 6.53347 6.40403 5.40375 7.37901 7.55196 numMergedOcc 0
24 mol 155 unq 2 iso 0 dist 7.36102 7.92304 5.50045 6.34186 7.37901 9.80845 numMergedOcc 0
25 mol 155 unq 3 iso 0 dist 8.27111 8.69157 6.00473 5.48883 8.73171 9.0529 numMergedOcc 0
26 mol 156 unq 0 iso 0 dist 8.47155 6.30021 10.0003 9.30783 6.90155 13.7525 numMergedOcc 0
27 mol 156 unq 1 iso 0 dist 9.36805 9.44367 10.143 7.29758 6.90155 5.81122 numMergedOcc 0
28 mol 156 unq 2 iso 0 dist 9.36805 9.47433 10.0003 7.29758 6.90155 13.7525 numMergedOcc 0
29 mol 156 unq 3 iso 0 dist 6.27641 9.4013 5.05683 6.29785 6.90155 10.735 numMergedOcc 0
30 mol 181 unq 0 iso 0 dist 6.94688 8.90963 4.43678 8.25067 8.20656 5.95304 numMergedOcc 0
31 mol 181 unq 1 iso 0 dist 6.71012 8.90963 6.03415 8.25067 9.40622 5.95304 numMergedOcc 0
32 mol 213 unq 0 iso 0 dist 9.59129 7.37798 12.1116 12.2579 8.74171 18.2483 numMergedOcc 0
33 mol 213 unq 1 iso 0 dist 9.59129 7.73322 9.93085 12.2579 8.74171 9.1514 numMergedOcc 0
34 mol 218 unq 0 iso 0 dist 7.17547 6.1951 7.21048 4.54272 8.57853 10.506 numMergedOcc 0
35 mol 218 unq 1 iso 0 dist 7.17547 6.1951 7.21048 10.2673 6.75035 13.3317 numMergedOcc 0
36 mol 224 unq 0 iso 0 dist 8.19953 9.51597 6.99977 7.67202 4.55996 8.08737 numMergedOcc 0
37 mol 232 unq 0 iso 0 dist 7.07392 8.50102 10.9886 6.66754 9.86861 15.1077 numMergedOcc 0
38 mol 234 unq 0 iso 0 dist 6.16063 6.30154 5.70413 5.9221 8.49841 11.6166 numMergedOcc 0
39 mol 234 unq 1 iso 0 dist 6.16063 7.32499 7.17691 5.9221 8.49841 7.43663 numMergedOcc 0
40 mol 235 unq 0 iso 0 dist 5.65339 6.21292 7.96337 6.43692 7.27958 12.1942 numMergedOcc 0
41 mol 235 unq 1 iso 0 dist 5.65339 6.95126 4.29892 6.43692 7.27958 7.95766 numMergedOcc 0
42 mol 238 unq 0 iso 0 dist 9.90142 7.57812 10.3147 15.7973 8.70193 18.5467 numMergedOcc 0
43 mol 238 unq 1 iso 0 dist 9.90142 8.69104 15.6823 15.7973 8.70193 23.3584 numMergedOcc 0
44 mol 238 unq 2 iso 0 dist 8.14172 7.02333 4.38002 5.68826 6.00721 7.04753 numMergedOcc 0
45 mol 238 unq 3 iso 0 dist 6.77463 8.67864 4.38002 4.87097 6.00721 7.04753 numMergedOcc 0
46 mol 239 unq 0 iso 0 dist 7.39747 9.01021 5.2908 7.04058 6.34801 10.9156 numMergedOcc 0
47 mol 274 unq 0 iso 0 dist 9.19234 9.45514 12.625 14.168 8.49866 12.6896 numMergedOcc 0
48 mol 274 unq 1 iso 0 dist 9.19234 6.39866 4.60275 14.168 8.49866 11.838 numMergedOcc 0
