0 mol 10 unq 0 iso 0 dist 9.03002 9.6309 6.45295 4.96625 10.2486 8.76873 numMergedOcc 0
1 mol 10 unq 1 iso 0 dist 9.03002 9.6309 6.45295 10.304 14.4379 9.58981 numMergedOcc 0
2 mol 10 unq 2 iso 0 dist 9.07663 4.94198 6.28462 3.97757 11.9687 8.28764 numMergedOcc 0
3 mol 10 unq 3 iso 0 dist 9.07663 9.62353 12.3985 3.97757 11.9687 9.41355 numMergedOcc 0
4 mol 59 unq 0 iso 0 dist 8.05508 9.34271 10.1462 14.4502 18.3152 8.69574 numMergedOcc 0
5 mol 59 unq 1 iso 0 dist 9.00229 9.34271 15.0017 14.4502 20.7186 8.69574 numMergedOcc 0
6 mol 69 unq 0 iso 0 dist 8.91902 9.56859 13.2678 7.55848 11.3547 5.75135 numMergedOcc 0
7 mol 69 unq 1 iso 0 dist 5.47319 5.75135 8.67853 7.55848 11.4076 9.56859 numMergedOcc 0
8 mol 69 unq 2 iso 0 dist 9.8809 5.75135 10.8149 7.55848 17.4028 9.56859 numMergedOcc 0
9 mol 92 unq 0 iso 0 dist 8.4545 7.29864 11.3522 12.0142 17.3351 6.04223 numMergedOcc 0
10 mol 92 unq 1 iso 0 dist 8.4545 7.7399 12.2908 6.46167 9.28057 5.48163 numMergedOcc 0
11 mol 92 unq 2 iso 0 dist 7.01176 7.29864 10.0591 12.0142 15.3509 6.04223 numMergedOcc 0
12 mol 92 unq 3 iso 0 dist 7.01176 7.7399 13.6054 6.46167 10.3713 5.48163 numMergedOcc 0
13 mol 98 unq 0 iso 0 dist 5.9747 9.68556 13.6536 4.66569 9.27497 8.73928 numMergedOcc 0
14 mol 128 unq 0 iso 0 dist 8.01677 5.38983 4.48309 9.43368 10.903 8.46801 numMergedOcc 0
15 mol 129 unq 0 iso 0 dist 6.38163 7.04904 10.3933 9.44114 14.1931 7.93106 numMergedOcc 0
16 mol 129 unq 1 iso 0 dist 6.38163 5.06053 9.27274 9.44114 14.1931 9.05575 numMergedOcc 0
17 mol 133 unq 0 iso 0 dist 9.3894 4.82356 6.12885 7.57921 14.1938 8.83476 numMergedOcc 0
18 mol 133 unq 1 iso 0 dist 9.50322 8.52036 10.3893 10.5425 12.969 8.22722 numMergedOcc 0
19 mol 133 unq 2 iso 0 dist 5.82404 8.52036 11.323 10.5425 9.84918 8.22722 numMergedOcc 0
20 mol 180 unq 0 iso 0 dist 9.88732 7.58661 4.38407 5.33436 5.77949 5.81023 numMergedOcc 0
21 mol 180 unq 1 iso 0 dist 9.88732 7.58661 4.38407 6.10537 8.68403 7.80553 numMergedOcc 0
22 mol 180 unq 2 iso 0 dist 9.88732 6.53993 9.89998 5.33436 5.77949 8.4285 numMergedOcc 0
23 mol 180 unq 3 iso 0 dist 9.88732 6.53993 9.89998 6.10537 8.68403 8.39019 numMergedOcc 0
24 mol 180 unq 4 iso 0 dist 5.77949 5.81023 4.38407 5.33436 9.88732 7.58661 numMergedOcc 0
25 mol 180 unq 5 iso 0 dist 5.77949 5.81023 4.38407 3.984 8.68403 7.80553 numMergedOcc 0
26 mol 180 unq 6 iso 0 dist 5.77949 8.4285 9.89998 5.33436 9.88732 6.53993 numMergedOcc 0
27 mol 180 unq 7 iso 0 dist 5.77949 8.4285 9.89998 3.984 8.68403 8.39019 numMergedOcc 0
28 mol 180 unq 8 iso 0 dist 8.68403 7.80553 4.38407 6.10537 9.88732 7.58661 numMergedOcc 0
29 mol 180 unq 9 iso 0 dist 8.68403 7.80553 4.38407 3.984 5.77949 5.81023 numMergedOcc 0
30 mol 180 unq 10 iso 0 dist 8.68403 8.39019 9.89998 6.10537 9.88732 6.53993 numMergedOcc 0
31 mol 180 unq 11 iso 0 dist 8.68403 8.39019 9.89998 3.984 5.77949 8.4285 numMergedOcc 0
32 mol 205 unq 0 iso 0 dist 6.752 8.93485 5.42503 4.20051 5.4913 5.66636 numMergedOcc 0
33 mol 205 unq 1 iso 0 dist 8.10287 5.66636 4.69695 4.20051 12.1752 8.93485 numMergedOcc 0
34 mol 205 unq 2 iso 0 dist 5.4913 5.66636 5.42503 4.20051 6.752 8.93485 numMergedOcc 0
35 mol 232 unq 0 iso 0 dist 9.56029 9.4726 5.00324 15.8224 13.042 8.32831 numMergedOcc 0
36 mol 232 unq 1 iso 0 dist 9.56029 9.4726 5.00324 12.5171 12.4205 7.91213 numMergedOcc 0
37 mol 232 unq 2 iso 0 dist 9.56029 9.4726 5.00324 9.9868 11.9284 9.33969 numMergedOcc 0
38 mol 277 unq 0 iso 0 dist 9.29635 5.11998 7.75371 12.609 14.3441 8.72101 numMergedOcc 0
39 mol 277 unq 1 iso 0 dist 9.29635 5.79925 11.3546 12.609 14.3441 8.75619 numMergedOcc 0
40 mol 277 unq 2 iso 0 dist 9.29635 5.79925 11.3546 11.9501 17.1656 8.55906 numMergedOcc 0
41 mol 277 unq 3 iso 0 dist 9.29635 5.79925 11.3546 9.40918 16.5518 5.55523 numMergedOcc 0
