0 mol 11 unq 0 iso 0 dist 9.42442 8.22997 12.7318 11.7321 18.8578 7.90478 numMergedOcc 0
1 mol 11 unq 1 iso 0 dist 9.42442 8.22997 12.7318 5.97265 14.8156 7.16561 numMergedOcc 0
2 mol 11 unq 2 iso 0 dist 8.07112 8.40993 6.17558 11.501 12.8775 7.46578 numMergedOcc 0
3 mol 11 unq 3 iso 0 dist 8.07112 8.40993 6.17558 5.91043 10.7263 7.16561 numMergedOcc 0
4 mol 11 unq 4 iso 0 dist 6.42494 8.22997 5.91043 11.7321 13.0752 7.90478 numMergedOcc 0
5 mol 11 unq 5 iso 0 dist 6.42494 8.22997 5.91043 5.97265 8.40993 7.16561 numMergedOcc 0
6 mol 11 unq 6 iso 0 dist 6.42494 8.40993 5.97265 11.501 12.6779 7.46578 numMergedOcc 0
7 mol 11 unq 7 iso 0 dist 6.42494 8.40993 5.97265 5.91043 8.22997 7.16561 numMergedOcc 0
8 mol 26 unq 0 iso 0 dist 8.6112 9.27369 10.5687 12.8556 16.9855 6.93197 numMergedOcc 0
9 mol 54 unq 0 iso 0 dist 9.5915 4.38047 12.377 10.5895 15.3557 9.17082 numMergedOcc 0
10 mol 92 unq 0 iso 0 dist 9.16403 7.7913 10.4698 11.9687 16.7771 6.77241 numMergedOcc 0
11 mol 92 unq 1 iso 0 dist 9.16403 7.7913 10.4698 12.841 13.7981 5.50508 numMergedOcc 0
12 mol 92 unq 2 iso 0 dist 9.59503 5.62309 11.9687 4.1125 7.7913 6.77241 numMergedOcc 0
13 mol 92 unq 3 iso 0 dist 9.59503 7.11438 12.841 4.1125 7.7913 5.50508 numMergedOcc 0
14 mol 92 unq 4 iso 0 dist 9.59503 7.7913 4.1125 11.9687 5.62309 6.77241 numMergedOcc 0
15 mol 92 unq 5 iso 0 dist 9.59503 7.7913 4.1125 12.841 7.11438 5.50508 numMergedOcc 0
16 mol 92 unq 6 iso 0 dist 9.61119 5.62309 11.8069 4.1125 10.8438 6.77241 numMergedOcc 0
17 mol 92 unq 7 iso 0 dist 9.61119 7.11438 15.4853 4.1125 10.8438 5.50508 numMergedOcc 0
18 mol 112 unq 0 iso 0 dist 7.84249 6.09626 6.62328 6.43704 5.42828 7.80873 numMergedOcc 0
19 mol 112 unq 1 iso 0 dist 7.84249 5.42828 6.43704 6.62328 6.09626 7.80873 numMergedOcc 0
20 mol 114 unq 0 iso 0 dist 8.53731 8.27794 5.21101 14.0508 13.4905 8.42878 numMergedOcc 0
21 mol 119 unq 0 iso 0 dist 7.72434 8.4733 13.0801 5.73999 12.3696 7.20249 numMergedOcc 0
22 mol 133 unq 0 iso 0 dist 7.12336 6.72323 12.6435 14.5316 18.2373 8.95662 numMergedOcc 0
23 mol 171 unq 0 iso 0 dist 8.59783 6.21194 4.98945 4.47323 8.81813 5.25109 numMergedOcc 0
24 mol 171 unq 1 iso 0 dist 8.59783 6.21194 4.98945 4.73373 10.1083 8.21618 numMergedOcc 0
25 mol 225 unq 0 iso 0 dist 8.31651 8.37379 4.14576 11.2979 12.0756 8.37739 numMergedOcc 0
26 mol 225 unq 1 iso 0 dist 8.31651 8.37379 4.14576 11.0488 13.2536 9.47237 numMergedOcc 0
27 mol 226 unq 0 iso 0 dist 9.37229 7.04477 13.3145 11.378 18.4632 5.70795 numMergedOcc 0
28 mol 244 unq 0 iso 0 dist 5.06669 5.79898 10.6799 4.38246 8.08939 6.22122 numMergedOcc 0
29 mol 244 unq 1 iso 0 dist 5.06669 8.08939 4.38246 8.89726 8.57917 7.95359 numMergedOcc 0
30 mol 244 unq 2 iso 0 dist 5.06669 8.08939 4.38246 10.6799 5.79898 6.22122 numMergedOcc 0
31 mol 244 unq 3 iso 0 dist 5.65248 5.79898 8.05133 4.38246 7.33574 6.22122 numMergedOcc 0
32 mol 244 unq 4 iso 0 dist 5.65248 7.33574 4.38246 4.55034 8.57917 7.95359 numMergedOcc 0
33 mol 244 unq 5 iso 0 dist 5.65248 7.33574 4.38246 8.05133 5.79898 6.22122 numMergedOcc 0
34 mol 249 unq 0 iso 0 dist 6.40339 6.58109 4.20164 6.02223 9.02777 5.9627 numMergedOcc 0
35 mol 292 unq 0 iso 0 dist 8.35169 6.68863 9.58852 10.8497 14.8292 8.25485 numMergedOcc 0
