0 mol 21 unq 0 iso 0 dist 8.07914 7.30397 4.89282 4.64562 8.53916 9.28842 numMergedOcc 0
1 mol 29 unq 0 iso 0 dist 5.36278 8.9204 7.29489 4.10356 7.28761 9.02912 numMergedOcc 0
2 mol 48 unq 0 iso 0 dist 9.53081 6.42242 5.84184 11.208 10.0984 5.7898 numMergedOcc 0
3 mol 73 unq 0 iso 0 dist 7.58027 6.82707 12.5165 8.15716 11.4491 9.69315 numMergedOcc 0
4 mol 73 unq 1 iso 0 dist 7.58027 6.82707 12.5165 15.2274 19.2099 8.96327 numMergedOcc 0
5 mol 73 unq 2 iso 0 dist 4.34694 6.82707 10.5011 8.15716 9.85641 9.69315 numMergedOcc 0
6 mol 73 unq 3 iso 0 dist 4.34694 6.82707 10.5011 15.2274 18.2744 8.96327 numMergedOcc 0
7 mol 105 unq 0 iso 0 dist 8.51572 9.23757 8.72987 5.27788 11.1425 6.84656 numMergedOcc 0
8 mol 116 unq 0 iso 0 dist 6.53824 9.2638 10.5909 16.4013 16.9165 9.28045 numMergedOcc 0
9 mol 116 unq 1 iso 0 dist 6.61973 9.2638 6.2875 16.4013 13.3842 9.28045 numMergedOcc 0
10 mol 147 unq 0 iso 0 dist 5.32865 8.40219 5.30729 10.7517 10.6715 6.75601 numMergedOcc 0
11 mol 148 unq 0 iso 0 dist 8.6953 6.86997 4.74651 13.2874 13.4628 9.87021 numMergedOcc 0
12 mol 148 unq 1 iso 0 dist 8.6953 7.46919 9.03832 13.2874 13.4628 7.34023 numMergedOcc 0
13 mol 150 unq 0 iso 0 dist 8.65967 6.79381 4.75241 13.3343 13.4812 9.96938 numMergedOcc 0
14 mol 150 unq 1 iso 0 dist 8.65967 7.36989 9.0892 13.3343 13.4812 7.35268 numMergedOcc 0
15 mol 171 unq 0 iso 0 dist 6.19457 6.4751 9.13204 13.1082 14.9255 6.73995 numMergedOcc 0
16 mol 171 unq 1 iso 0 dist 6.19457 6.4751 9.13204 13.0534 14.175 8.619 numMergedOcc 0
17 mol 220 unq 0 iso 0 dist 6.50756 8.32948 11.1785 8.9233 14.4416 6.174 numMergedOcc 0
18 mol 232 unq 0 iso 0 dist 6.77822 6.83927 4.06349 9.84054 11.8317 9.72906 numMergedOcc 0
19 mol 232 unq 1 iso 0 dist 6.77822 9.25162 9.4234 9.84054 11.8317 6.02641 numMergedOcc 0
20 mol 254 unq 0 iso 0 dist 9.54511 7.00841 9.6988 9.92619 9.56058 9.43169 numMergedOcc 0
21 mol 254 unq 1 iso 0 dist 9.54511 7.00841 9.6988 6.33436 12.3716 5.9438 numMergedOcc 0
22 mol 258 unq 0 iso 0 dist 9.8165 8.51736 10.5286 7.47952 14.0084 5.96512 numMergedOcc 0
23 mol 282 unq 0 iso 0 dist 8.54984 8.42086 6.45254 13.09 14.1703 9.87988 numMergedOcc 0
24 mol 282 unq 1 iso 0 dist 6.04225 8.42086 4.0078 13.09 12.8958 9.87988 numMergedOcc 0
25 mol 282 unq 2 iso 0 dist 5.00258 7.84236 4.0078 14.0507 12.8958 9.87988 numMergedOcc 0
26 mol 282 unq 3 iso 0 dist 9.98886 7.84236 12.9261 14.0507 21.2006 9.87988 numMergedOcc 0
