0 mol 7 unq 0 iso 0 dist 9.26914 12.1468 7.10621 17.038 8.72114 13.8829 numMergedOcc 0
1 mol 54 unq 0 iso 0 dist 6.29729 5.50049 6.83299 7.33412 6.14538 4.29856 numMergedOcc 0
2 mol 59 unq 0 iso 0 dist 7.40411 11.5553 7.71095 8.26644 6.73347 9.64444 numMergedOcc 0
3 mol 59 unq 1 iso 0 dist 7.40411 6.31307 8.84665 8.26644 6.73347 4.36133 numMergedOcc 0
4 mol 59 unq 2 iso 0 dist 7.40411 5.76625 8.25513 8.26644 6.73347 6.66692 numMergedOcc 0
5 mol 61 unq 0 iso 0 dist 6.97123 7.20068 6.65721 7.69177 9.25641 13.5488 numMergedOcc 0
6 mol 72 unq 0 iso 0 dist 7.60252 7.54416 8.8178 9.17208 9.27838 15.434 numMergedOcc 0
7 mol 72 unq 1 iso 0 dist 7.60252 9.89539 9.96708 9.17208 9.27838 11.6378 numMergedOcc 0
8 mol 92 unq 0 iso 0 dist 8.79958 8.55171 9.33898 16.7596 8.91313 17.5889 numMergedOcc 0
9 mol 92 unq 1 iso 0 dist 8.79958 8.55171 9.33898 10.5288 8.16392 10.8304 numMergedOcc 0
10 mol 92 unq 2 iso 0 dist 8.79958 8.36426 9.64443 16.7596 8.91313 13.3881 numMergedOcc 0
11 mol 92 unq 3 iso 0 dist 8.79958 8.36426 9.64443 10.5288 8.16392 5.90097 numMergedOcc 0
12 mol 92 unq 4 iso 0 dist 9.18852 16.05 9.33898 8.51668 8.91313 17.5889 numMergedOcc 0
13 mol 92 unq 5 iso 0 dist 9.18852 16.05 9.33898 7.07591 8.16392 10.8304 numMergedOcc 0
14 mol 92 unq 6 iso 0 dist 9.18852 5.89198 9.64443 8.51668 8.91313 13.3881 numMergedOcc 0
15 mol 92 unq 7 iso 0 dist 9.18852 5.89198 9.64443 7.07591 8.16392 5.90097 numMergedOcc 0
16 mol 95 unq 0 iso 0 dist 6.12086 13.7041 9.03572 6.50009 9.49454 13.3662 numMergedOcc 0
17 mol 95 unq 1 iso 0 dist 6.12086 11.3093 8.83255 6.50009 9.49454 12.0666 numMergedOcc 0
18 mol 95 unq 2 iso 0 dist 6.12086 4.98369 8.03644 6.50009 9.49454 11.4333 numMergedOcc 0
19 mol 95 unq 3 iso 0 dist 7.93544 11.3277 9.03572 10.8302 9.49454 13.3662 numMergedOcc 0
20 mol 95 unq 4 iso 0 dist 7.93544 5.822 8.83255 10.8302 9.49454 12.0666 numMergedOcc 0
21 mol 95 unq 5 iso 0 dist 7.93544 9.11942 8.03644 10.8302 9.49454 11.4333 numMergedOcc 0
22 mol 109 unq 0 iso 0 dist 5.8729 9.80725 8.69985 12.6824 7.80523 7.74599 numMergedOcc 0
23 mol 122 unq 0 iso 0 dist 5.94669 5.89212 8.37808 6.71742 8.88537 5.0355 numMergedOcc 0
24 mol 122 unq 1 iso 0 dist 5.94669 5.89212 8.37808 4.7859 9.23819 7.39059 numMergedOcc 0
25 mol 131 unq 0 iso 0 dist 6.65519 4.88092 6.85062 15.1611 8.70296 14.2045 numMergedOcc 0
26 mol 131 unq 1 iso 0 dist 6.65519 4.88092 6.85062 7.93002 9.25558 5.09131 numMergedOcc 0
27 mol 133 unq 0 iso 0 dist 6.70271 10.8963 7.11802 7.9145 9.22232 16.0138 numMergedOcc 0
28 mol 133 unq 1 iso 0 dist 6.70271 10.8963 7.11802 14.5816 9.22661 5.92062 numMergedOcc 0
29 mol 133 unq 2 iso 0 dist 6.70271 10.8963 7.11802 13.5985 7.56378 6.61891 numMergedOcc 0
30 mol 133 unq 3 iso 0 dist 5.44721 5.0869 6.29155 5.63869 6.16242 4.54648 numMergedOcc 0
31 mol 180 unq 0 iso 0 dist 8.31244 6.84196 9.62337 8.65672 5.85827 8.78204 numMergedOcc 0
32 mol 182 unq 0 iso 0 dist 9.92736 14.6185 9.31746 11.2491 6.73956 7.68794 numMergedOcc 0
33 mol 182 unq 1 iso 0 dist 9.92736 14.6185 9.31746 15.7347 7.09394 9.37404 numMergedOcc 0
34 mol 205 unq 0 iso 0 dist 6.40983 8.48013 6.03031 6.11697 6.03688 8.15057 numMergedOcc 0
35 mol 205 unq 1 iso 0 dist 6.40983 9.6739 7.26832 6.11697 6.03688 12.4957 numMergedOcc 0
36 mol 205 unq 2 iso 0 dist 6.40983 11.3983 7.80463 6.11697 6.03688 6.09749 numMergedOcc 0
37 mol 206 unq 0 iso 0 dist 6.78537 9.45246 7.7366 11.9537 6.16414 6.45859 numMergedOcc 0
38 mol 206 unq 1 iso 0 dist 6.78537 9.45246 7.7366 9.52969 7.33701 4.40897 numMergedOcc 0
39 mol 206 unq 2 iso 0 dist 6.78537 9.45246 7.7366 7.66993 8.0871 7.62219 numMergedOcc 0
40 mol 231 unq 0 iso 0 dist 6.52115 12.4148 7.37839 6.67463 7.79066 9.0443 numMergedOcc 0
41 mol 231 unq 1 iso 0 dist 6.52115 14.0894 8.40182 6.67463 7.79066 12.1512 numMergedOcc 0
42 mol 231 unq 2 iso 0 dist 9.88437 5.20569 7.37839 6.8619 7.79066 9.0443 numMergedOcc 0
43 mol 231 unq 3 iso 0 dist 9.88437 8.35245 8.40182 6.8619 7.79066 12.1512 numMergedOcc 0
44 mol 259 unq 0 iso 0 dist 9.07855 15.5856 7.46176 11.8656 7.08526 8.81835 numMergedOcc 0
45 mol 264 unq 0 iso 0 dist 7.51284 11.5015 6.24356 4.51189 5.93616 7.52936 numMergedOcc 0
46 mol 264 unq 1 iso 0 dist 5.99069 5.68295 9.361 9.91912 7.16853 11.1431 numMergedOcc 0
47 mol 264 unq 2 iso 0 dist 5.99069 6.99623 6.24356 9.91912 7.16853 5.00209 numMergedOcc 0
48 mol 278 unq 0 iso 0 dist 8.8437 8.4608 8.44326 6.83323 8.00673 4.97614 numMergedOcc 0
