0 mol 2 unq 0 iso 0 dist 5.5745 8.5893 8.75089 4.00237 6.90295 5.74846 numMergedOcc 0
1 mol 2 unq 1 iso 0 dist 5.5745 8.29974 8.39246 4.00237 6.90295 4.93584 numMergedOcc 0
2 mol 9 unq 0 iso 0 dist 6.51397 8.79695 4.84673 12.8646 8.14998 9.3584 numMergedOcc 0
3 mol 9 unq 1 iso 0 dist 6.51397 5.2505 7.18286 12.8646 8.14998 15.1312 numMergedOcc 0
4 mol 43 unq 0 iso 0 dist 8.38387 9.52295 6.09486 4.15592 9.02471 10.4804 numMergedOcc 0
5 mol 59 unq 0 iso 0 dist 9.00229 8.11934 5.43926 4.82623 8.30217 6.10199 numMergedOcc 0
6 mol 78 unq 0 iso 0 dist 9.23023 9.739 5.40759 15.9532 7.91148 12.6919 numMergedOcc 0
7 mol 78 unq 1 iso 0 dist 9.23023 9.739 5.40759 14.6188 6.59794 11.2592 numMergedOcc 0
8 mol 78 unq 2 iso 0 dist 9.23023 9.739 5.40759 15.1992 8.34957 12.8456 numMergedOcc 0
9 mol 88 unq 0 iso 0 dist 7.74197 6.64933 11.9839 12.4888 9.07128 18.5551 numMergedOcc 0
10 mol 88 unq 1 iso 0 dist 7.74197 6.64933 11.9839 6.15983 6.65615 11.4934 numMergedOcc 0
11 mol 88 unq 2 iso 0 dist 7.74197 8.67727 11.2929 12.4888 9.07128 18.7115 numMergedOcc 0
12 mol 88 unq 3 iso 0 dist 7.74197 8.67727 11.2929 6.15983 6.65615 11.8985 numMergedOcc 0
13 mol 88 unq 4 iso 0 dist 7.86537 6.64933 10.6664 6.15983 5.07548 11.4934 numMergedOcc 0
14 mol 88 unq 5 iso 0 dist 7.86537 8.67727 9.259 6.15983 5.07548 11.8985 numMergedOcc 0
15 mol 88 unq 6 iso 0 dist 6.35462 6.64933 4.79268 4.56066 7.74064 9.06249 numMergedOcc 0
16 mol 88 unq 7 iso 0 dist 6.35462 8.67727 6.3984 4.56066 7.74064 12.1455 numMergedOcc 0
17 mol 119 unq 0 iso 0 dist 7.91337 8.04669 12.378 3.80816 4.80684 10.6912 numMergedOcc 0
18 mol 119 unq 1 iso 0 dist 7.91337 7.46162 12.5595 3.80816 4.80684 10.3844 numMergedOcc 0
19 mol 119 unq 2 iso 0 dist 6.40546 8.04669 8.87718 3.80816 7.60162 10.6912 numMergedOcc 0
20 mol 119 unq 3 iso 0 dist 6.40546 7.46162 4.72999 3.80816 7.60162 10.3844 numMergedOcc 0
21 mol 152 unq 0 iso 0 dist 8.07256 9.06801 5.97115 12.8334 9.00072 7.78215 numMergedOcc 0
22 mol 157 unq 0 iso 0 dist 6.1835 6.09357 3.8758 6.11737 8.10592 5.32542 numMergedOcc 0
23 mol 162 unq 0 iso 0 dist 9.97921 8.99034 5.05715 10.0292 7.93088 9.67872 numMergedOcc 0
24 mol 167 unq 0 iso 0 dist 5.59806 6.00793 6.38496 5.09728 5.36671 9.87581 numMergedOcc 0
25 mol 175 unq 0 iso 0 dist 8.58906 9.52193 3.98983 3.47137 9.32259 11.4625 numMergedOcc 0
26 mol 186 unq 0 iso 0 dist 7.80299 9.21553 5.04574 5.18174 9.65093 10.6483 numMergedOcc 0
27 mol 206 unq 0 iso 0 dist 9.78438 6.38964 6.13816 10.3421 9.4629 7.51798 numMergedOcc 0
28 mol 222 unq 0 iso 0 dist 9.55777 8.33743 8.6493 9.08651 5.1609 8.47836 numMergedOcc 0
29 mol 225 unq 0 iso 0 dist 9.86371 9.28645 4.04791 6.9328 8.40074 9.57433 numMergedOcc 0
30 mol 225 unq 1 iso 0 dist 9.86371 9.80348 11.4868 6.9328 8.40074 13.7464 numMergedOcc 0
31 mol 225 unq 2 iso 0 dist 9.13552 8.9785 4.04791 3.90226 8.40074 9.57433 numMergedOcc 0
32 mol 274 unq 0 iso 0 dist 8.49076 9.35835 12.292 7.72539 8.12739 8.87546 numMergedOcc 0
33 mol 274 unq 1 iso 0 dist 8.49076 9.35835 12.292 8.78528 6.09853 13.5735 numMergedOcc 0
34 mol 277 unq 0 iso 0 dist 8.11838 5.56721 6.2159 4.20802 5.72327 6.12608 numMergedOcc 0
35 mol 277 unq 1 iso 0 dist 7.88897 5.56721 4.39241 4.20802 5.81301 6.12608 numMergedOcc 0
36 mol 292 unq 0 iso 0 dist 7.53641 8.25719 9.6563 6.97445 6.69619 13.2002 numMergedOcc 0
37 mol 292 unq 1 iso 0 dist 7.53641 8.25719 9.6563 5.33412 4.49592 9.65095 numMergedOcc 0
