0 mol 9 unq 0 iso 0 dist 9.45451 10.699 8.59513 11.4615 13.4295 8.48677 numMergedOcc 0
1 mol 54 unq 0 iso 0 dist 9.63616 5.01159 5.27979 10.5929 7.15034 6.14538 numMergedOcc 0
2 mol 98 unq 0 iso 0 dist 8.73798 4.81103 7.54574 5.85841 9.53244 5.78706 numMergedOcc 0
3 mol 98 unq 1 iso 0 dist 8.73798 4.81103 7.54574 11.1652 9.91282 7.23884 numMergedOcc 0
4 mol 98 unq 2 iso 0 dist 8.73798 4.81103 7.54574 7.00285 6.54016 5.59328 numMergedOcc 0
5 mol 98 unq 3 iso 0 dist 8.73798 4.81103 7.54574 11.8527 11.2206 7.5242 numMergedOcc 0
6 mol 98 unq 4 iso 0 dist 5.24616 7.22196 7.54574 6.78839 9.53244 5.78706 numMergedOcc 0
7 mol 98 unq 5 iso 0 dist 5.24616 7.22196 7.54574 11.1321 9.91282 7.23884 numMergedOcc 0
8 mol 98 unq 6 iso 0 dist 5.24616 7.22196 7.54574 8.02354 6.54016 5.59328 numMergedOcc 0
9 mol 98 unq 7 iso 0 dist 5.24616 7.22196 7.54574 13.7128 11.2206 7.5242 numMergedOcc 0
10 mol 101 unq 0 iso 0 dist 6.54699 9.70552 9.44645 8.97911 6.2696 6.98314 numMergedOcc 0
11 mol 101 unq 1 iso 0 dist 6.54699 9.70552 9.44645 14.2649 10.1773 7.61685 numMergedOcc 0
12 mol 135 unq 0 iso 0 dist 6.63808 11.5311 7.02963 15.4642 10.9403 5.62052 numMergedOcc 0
13 mol 135 unq 1 iso 0 dist 6.63808 11.5311 7.02963 11.8777 8.06169 7.85645 numMergedOcc 0
14 mol 141 unq 0 iso 0 dist 7.57472 6.69013 4.92382 9.92487 8.76709 8.10291 numMergedOcc 0
15 mol 141 unq 1 iso 0 dist 7.43045 10.537 9.62774 13.5907 6.80544 9.87644 numMergedOcc 0
16 mol 158 unq 0 iso 0 dist 4.68068 4.29509 7.20362 8.59098 6.05019 8.647 numMergedOcc 0
17 mol 205 unq 0 iso 0 dist 8.27988 9.83112 5.59832 13.3872 6.49049 6.03688 numMergedOcc 0
18 mol 205 unq 1 iso 0 dist 4.29411 5.07333 7.13824 6.15806 4.30308 5.44002 numMergedOcc 0
19 mol 222 unq 0 iso 0 dist 8.33245 10.4275 9.30639 13.0107 6.70898 9.07471 numMergedOcc 0
20 mol 241 unq 0 iso 0 dist 9.87415 9.36013 8.73192 10.4415 4.07839 7.89524 numMergedOcc 0
21 mol 249 unq 0 iso 0 dist 5.7671 10.5246 8.76518 11.455 10.3504 5.48118 numMergedOcc 0
22 mol 249 unq 1 iso 0 dist 5.7671 10.5246 8.76518 14.3782 10.9925 7.25858 numMergedOcc 0
23 mol 274 unq 0 iso 0 dist 9.76634 6.84952 8.09181 12.1604 12.5154 8.52587 numMergedOcc 0
24 mol 274 unq 1 iso 0 dist 9.76634 6.84952 8.09181 11.1412 4.60007 6.39866 numMergedOcc 0
25 mol 278 unq 0 iso 0 dist 5.35362 7.41736 8.1769 13.1685 13.7796 8.00673 numMergedOcc 0
26 mol 278 unq 1 iso 0 dist 5.35362 7.41736 8.1769 11.764 9.26354 6.62841 numMergedOcc 0
27 mol 278 unq 2 iso 0 dist 8.22364 7.41736 7.1656 13.1685 10.2359 8.00673 numMergedOcc 0
28 mol 278 unq 3 iso 0 dist 8.22364 7.41736 7.1656 11.764 5.33325 6.62841 numMergedOcc 0
29 mol 287 unq 0 iso 0 dist 9.57637 13.8928 9.25759 21.243 13.2948 8.91712 numMergedOcc 0
30 mol 287 unq 1 iso 0 dist 9.57637 13.8928 9.25759 13.1539 3.65199 9.65934 numMergedOcc 0
31 mol 288 unq 0 iso 0 dist 9.57637 13.8928 9.25759 21.243 13.2948 8.91712 numMergedOcc 0
32 mol 288 unq 1 iso 0 dist 9.57637 13.8928 9.25759 13.1539 3.65199 9.65934 numMergedOcc 0
33 mol 289 unq 0 iso 0 dist 9.57637 13.8928 9.25759 21.243 13.2948 8.91712 numMergedOcc 0
34 mol 289 unq 1 iso 0 dist 9.57637 13.8928 9.25759 13.1539 3.65199 9.65934 numMergedOcc 0
