0 mol 12 unq 0 iso 0 dist 8.8993 5.44478 8.27891 8.79013 6.62201 5.03514 numMergedOcc 0
1 mol 36 unq 0 iso 0 dist 9.54644 4.10339 13.1554 6.1084 6.41221 9.13645 numMergedOcc 0
2 mol 62 unq 0 iso 0 dist 6.69386 7.30392 5.95499 5.92285 6.44497 10.9045 numMergedOcc 0
3 mol 62 unq 1 iso 0 dist 6.69386 7.30392 5.95499 8.38687 13.6782 15.6343 numMergedOcc 0
4 mol 62 unq 2 iso 0 dist 9.09269 7.30392 16.2245 5.92285 8.03921 10.9045 numMergedOcc 0
5 mol 62 unq 3 iso 0 dist 9.09269 7.30392 16.2245 8.38687 3.83635 15.6343 numMergedOcc 0
6 mol 69 unq 0 iso 0 dist 8.61203 8.20839 4.73219 6.22498 4.13643 3.83791 numMergedOcc 0
7 mol 103 unq 0 iso 0 dist 9.66944 5.72494 4.37349 9.43076 4.3208 4.78648 numMergedOcc 0
8 mol 103 unq 1 iso 0 dist 9.66944 8.70106 9.29681 9.43076 4.3208 10.6434 numMergedOcc 0
9 mol 123 unq 0 iso 0 dist 9.61215 9.01131 11.4714 7.91608 10.518 5.23317 numMergedOcc 0
10 mol 125 unq 0 iso 0 dist 9.06392 4.81596 11.9038 9.69767 16.0066 5.72858 numMergedOcc 0
11 mol 157 unq 0 iso 0 dist 7.78927 6.66184 6.72897 4.20542 6.17631 5.332 numMergedOcc 0
12 mol 157 unq 1 iso 0 dist 7.78927 6.66184 6.72897 8.40948 3.80096 7.95661 numMergedOcc 0
13 mol 178 unq 0 iso 0 dist 5.79795 7.33326 10.5369 8.74572 3.93042 14.0884 numMergedOcc 0
14 mol 178 unq 1 iso 0 dist 5.79795 7.33326 10.5369 8.62441 3.95924 11.0838 numMergedOcc 0
15 mol 182 unq 0 iso 0 dist 8.86262 7.03216 10.4612 8.45614 4.66231 12.8965 numMergedOcc 0
16 mol 182 unq 1 iso 0 dist 8.86262 9.42196 13.4338 8.45614 4.66231 13.9118 numMergedOcc 0
17 mol 182 unq 2 iso 0 dist 7.23874 7.03216 5.3582 8.45614 9.47983 12.8965 numMergedOcc 0
18 mol 182 unq 3 iso 0 dist 7.23874 9.42196 8.2857 8.45614 9.47983 13.9118 numMergedOcc 0
19 mol 282 unq 0 iso 0 dist 8.07221 7.28238 7.88907 9.07173 10.3404 7.78603 numMergedOcc 0
20 mol 282 unq 1 iso 0 dist 8.07221 7.3389 5.6541 9.07173 10.3404 8.55841 numMergedOcc 0
21 mol 284 unq 0 iso 0 dist 7.41633 5.62295 12.6047 6.52085 11.6034 7.38786 numMergedOcc 0
22 mol 284 unq 1 iso 0 dist 7.41633 5.62295 12.6047 9.84174 14.3977 11.9492 numMergedOcc 0
23 mol 284 unq 2 iso 0 dist 5.52837 5.62295 10.936 6.52085 8.17165 7.38786 numMergedOcc 0
24 mol 284 unq 3 iso 0 dist 5.52837 5.62295 10.936 9.84174 11.148 11.9492 numMergedOcc 0
25 mol 284 unq 4 iso 0 dist 6.73163 5.62295 10.1049 6.52085 4.03077 7.38786 numMergedOcc 0
26 mol 284 unq 5 iso 0 dist 6.73163 5.62295 10.1049 9.84174 11.131 11.9492 numMergedOcc 0
27 mol 287 unq 0 iso 0 dist 6.81636 4.66252 4.76371 7.74312 8.93497 10.6613 numMergedOcc 0
28 mol 288 unq 0 iso 0 dist 6.81636 4.66252 4.76371 7.74312 8.93497 10.6613 numMergedOcc 0
29 mol 289 unq 0 iso 0 dist 6.81636 4.66252 4.76371 7.74312 8.93497 10.6613 numMergedOcc 0
