0 mol 1 unq 0 iso 0 dist 9.33719 8.70365 11.7763 7.16224 5.74199 12.0223 numMergedOcc 0
1 mol 2 unq 0 iso 0 dist 9.40823 8.66033 6.23988 5.31104 9.08872 9.74371 numMergedOcc 0
2 mol 2 unq 1 iso 0 dist 9.40823 8.66033 6.23988 10.2334 7.37296 11.9277 numMergedOcc 0
3 mol 2 unq 2 iso 0 dist 8.66033 9.40823 6.23988 5.31104 9.74371 9.08872 numMergedOcc 0
4 mol 7 unq 0 iso 0 dist 8.81871 9.71959 5.63739 16.368 8.0166 9.32945 numMergedOcc 0
5 mol 7 unq 1 iso 0 dist 9.71959 8.81871 5.63739 5.46848 9.67498 11.1694 numMergedOcc 0
6 mol 7 unq 2 iso 0 dist 9.71959 8.81871 5.63739 16.368 9.32945 8.0166 numMergedOcc 0
7 mol 14 unq 0 iso 0 dist 9.60834 9.11167 6.23746 4.49408 8.19687 5.71901 numMergedOcc 0
8 mol 14 unq 1 iso 0 dist 9.11167 9.60834 6.23746 4.49408 5.71901 8.19687 numMergedOcc 0
9 mol 73 unq 0 iso 0 dist 8.91858 7.5442 4.4628 12.7633 9.27355 8.60363 numMergedOcc 0
10 mol 73 unq 1 iso 0 dist 7.5442 8.91858 4.4628 12.7633 8.60363 9.27355 numMergedOcc 0
11 mol 73 unq 2 iso 0 dist 7.5442 8.91858 4.4628 5.19187 9.27331 10.0291 numMergedOcc 0
12 mol 130 unq 0 iso 0 dist 8.25442 9.57695 4.80422 11.0509 7.9663 10.0434 numMergedOcc 0
13 mol 130 unq 1 iso 0 dist 8.25442 9.57695 4.80422 5.65698 6.54338 9.39135 numMergedOcc 0
14 mol 130 unq 2 iso 0 dist 8.25442 9.57695 4.80422 4.61946 7.47653 8.97124 numMergedOcc 0
15 mol 130 unq 3 iso 0 dist 9.57695 8.25442 4.80422 5.65698 9.39135 6.54338 numMergedOcc 0
16 mol 130 unq 4 iso 0 dist 9.57695 8.25442 4.80422 4.61946 8.97124 7.47653 numMergedOcc 0
17 mol 143 unq 0 iso 0 dist 7.19059 8.20024 9.88692 4.42628 7.64085 12.3853 numMergedOcc 0
18 mol 148 unq 0 iso 0 dist 8.63766 7.76167 7.64654 16.8544 9.71692 15.1517 numMergedOcc 0
19 mol 148 unq 1 iso 0 dist 8.63766 8.42082 12.4819 16.8544 9.71692 18.9172 numMergedOcc 0
20 mol 150 unq 0 iso 0 dist 8.7107 7.83202 7.66386 16.9387 9.73708 15.246 numMergedOcc 0
21 mol 150 unq 1 iso 0 dist 8.7107 8.47493 12.4343 16.9387 9.73708 18.9215 numMergedOcc 0
22 mol 199 unq 0 iso 0 dist 7.21813 6.6037 5.72642 11.6262 9.88917 11.0387 numMergedOcc 0
23 mol 199 unq 1 iso 0 dist 7.21813 9.74632 10.3162 11.6262 9.88917 9.56785 numMergedOcc 0
24 mol 199 unq 2 iso 0 dist 9.74632 6.6037 6.01111 11.6262 9.56785 11.0387 numMergedOcc 0
25 mol 199 unq 3 iso 0 dist 9.74632 7.21813 10.3162 11.6262 9.56785 9.88917 numMergedOcc 0
26 mol 205 unq 0 iso 0 dist 9.10711 8.94211 8.7106 10.8277 9.68829 16.3182 numMergedOcc 0
27 mol 205 unq 1 iso 0 dist 9.10711 8.94211 8.7106 13.6126 7.75205 13.3028 numMergedOcc 0
28 mol 210 unq 0 iso 0 dist 8.87835 8.93859 9.07869 7.45619 6.24111 8.60412 numMergedOcc 0
29 mol 210 unq 1 iso 0 dist 8.87835 8.93859 9.07869 4.70332 9.00343 7.05535 numMergedOcc 0
30 mol 210 unq 2 iso 0 dist 8.87835 8.93859 9.07869 8.57997 6.41444 13.463 numMergedOcc 0
31 mol 210 unq 3 iso 0 dist 8.93859 8.87835 9.07869 7.45619 8.60412 6.24111 numMergedOcc 0
32 mol 210 unq 4 iso 0 dist 8.93859 8.87835 9.07869 4.70332 7.05535 9.00343 numMergedOcc 0
33 mol 220 unq 0 iso 0 dist 7.03223 4.58449 7.92759 4.36623 7.35148 8.80872 numMergedOcc 0
34 mol 244 unq 0 iso 0 dist 6.59726 7.14718 5.61236 9.27415 6.51428 11.8474 numMergedOcc 0
35 mol 249 unq 0 iso 0 dist 8.09174 9.08729 5.2966 11.359 6.18866 9.3807 numMergedOcc 0
36 mol 249 unq 1 iso 0 dist 9.08729 8.09174 5.2966 11.359 9.3807 6.18866 numMergedOcc 0
37 mol 250 unq 0 iso 0 dist 9.68049 8.19924 5.01048 4.06429 8.38141 5.08366 numMergedOcc 0
38 mol 250 unq 1 iso 0 dist 9.68049 8.01457 12.269 4.06429 8.38141 8.18086 numMergedOcc 0
39 mol 250 unq 2 iso 0 dist 8.19924 9.68049 5.01048 4.06429 5.08366 8.38141 numMergedOcc 0
40 mol 250 unq 3 iso 0 dist 8.19924 8.01457 9.8248 4.06429 5.08366 8.18086 numMergedOcc 0
41 mol 250 unq 4 iso 0 dist 8.01457 9.68049 12.269 4.06429 8.18086 8.38141 numMergedOcc 0
42 mol 250 unq 5 iso 0 dist 8.01457 8.19924 9.8248 4.06429 8.18086 5.08366 numMergedOcc 0
43 mol 282 unq 0 iso 0 dist 9.40138 8.37963 17.6519 5.64349 7.93511 12.1147 numMergedOcc 0
44 mol 294 unq 0 iso 0 dist 6.075 5.27696 4.46072 7.71145 5.76337 9.39625 numMergedOcc 0
45 mol 294 unq 1 iso 0 dist 6.075 5.27696 4.46072 3.95468 8.60441 6.97558 numMergedOcc 0
46 mol 294 unq 2 iso 0 dist 5.27696 6.075 4.46072 7.71145 9.39625 5.76337 numMergedOcc 0
47 mol 294 unq 3 iso 0 dist 5.27696 6.075 4.46072 3.95468 6.97558 8.60441 numMergedOcc 0
