0 mol 11 unq 0 iso 0 dist 9.07476 9.89387 5.47299 5.23547 9.89425 12.9682 numMergedOcc 0
1 mol 34 unq 0 iso 0 dist 7.36836 5.89139 5.68794 6.99091 7.34832 4.76075 numMergedOcc 0
2 mol 34 unq 1 iso 0 dist 7.36836 10.4748 8.9964 6.99091 7.34832 6.64474 numMergedOcc 0
3 mol 62 unq 0 iso 0 dist 6.35779 5.02909 8.96898 5.46563 9.19512 5.91118 numMergedOcc 0
4 mol 62 unq 1 iso 0 dist 7.25138 11.1544 7.01397 5.56988 7.16844 11.5628 numMergedOcc 0
5 mol 67 unq 0 iso 0 dist 8.4702 5.66613 9.10001 3.77705 5.88409 3.83735 numMergedOcc 0
6 mol 81 unq 0 iso 0 dist 9.53663 8.00722 8.57764 7.58448 8.96045 4.54161 numMergedOcc 0
7 mol 93 unq 0 iso 0 dist 5.10693 4.1947 8.24402 3.91263 6.67678 4.85981 numMergedOcc 0
8 mol 93 unq 1 iso 0 dist 6.58814 9.45097 9.44156 3.91263 7.24956 6.38065 numMergedOcc 0
9 mol 93 unq 2 iso 0 dist 6.13459 4.1947 7.14241 3.91263 8.28591 4.85981 numMergedOcc 0
10 mol 93 unq 3 iso 0 dist 6.13459 4.1947 7.14241 5.59024 5.35008 4.03764 numMergedOcc 0
11 mol 93 unq 4 iso 0 dist 6.13459 4.1947 7.14241 12.9872 8.30921 14.2411 numMergedOcc 0
12 mol 101 unq 0 iso 0 dist 6.67863 6.01775 7.33426 13.2642 9.33112 9.92742 numMergedOcc 0
13 mol 101 unq 1 iso 0 dist 6.67863 12.2942 8.17175 13.2642 9.33112 3.73374 numMergedOcc 0
14 mol 169 unq 0 iso 0 dist 7.78577 11.8115 6.27378 8.55252 8.6961 7.58935 numMergedOcc 0
15 mol 176 unq 0 iso 0 dist 9.09554 8.80566 8.0255 3.94408 9.9109 6.79029 numMergedOcc 0
16 mol 186 unq 0 iso 0 dist 4.37577 7.99002 8.35588 3.6848 7.36794 11.3012 numMergedOcc 0
17 mol 186 unq 1 iso 0 dist 4.37577 7.99002 8.35588 5.33968 5.81881 11.3698 numMergedOcc 0
18 mol 205 unq 0 iso 0 dist 8.25174 11.1756 9.95859 7.54616 7.4185 3.73699 numMergedOcc 0
19 mol 205 unq 1 iso 0 dist 9.16671 6.67537 9.95859 3.69062 7.4185 3.73699 numMergedOcc 0
20 mol 239 unq 0 iso 0 dist 8.53092 4.95839 4.44509 5.59638 7.97504 4.08014 numMergedOcc 0
21 mol 254 unq 0 iso 0 dist 7.89302 4.67942 9.83135 5.06168 5.6417 7.03003 numMergedOcc 0
22 mol 254 unq 1 iso 0 dist 7.89302 4.67942 9.83135 6.25965 7.42831 9.54026 numMergedOcc 0
23 mol 260 unq 0 iso 0 dist 9.46576 9.87568 4.76164 17.1277 9.73217 14.0954 numMergedOcc 0
24 mol 260 unq 1 iso 0 dist 9.46576 9.87568 4.76164 6.73886 7.49606 4.58993 numMergedOcc 0
25 mol 260 unq 2 iso 0 dist 9.46576 9.87568 4.76164 11.1586 8.06377 3.69763 numMergedOcc 0
26 mol 266 unq 0 iso 0 dist 9.35293 11.141 7.74133 10.858 8.20376 15.5262 numMergedOcc 0
27 mol 266 unq 1 iso 0 dist 7.93375 12.1796 7.74133 7.54309 8.20376 15.5262 numMergedOcc 0
28 mol 287 unq 0 iso 0 dist 9.40443 5.24841 5.44942 8.85995 8.32982 6.71401 numMergedOcc 0
29 mol 287 unq 1 iso 0 dist 9.40443 5.1508 8.53689 8.85995 8.32982 4.06127 numMergedOcc 0
30 mol 287 unq 2 iso 0 dist 9.40443 13.9608 7.82157 8.85995 8.32982 10.5401 numMergedOcc 0
31 mol 288 unq 0 iso 0 dist 9.40443 5.24841 5.44942 8.85995 8.32982 6.71401 numMergedOcc 0
32 mol 288 unq 1 iso 0 dist 9.40443 5.1508 8.53689 8.85995 8.32982 4.06127 numMergedOcc 0
33 mol 288 unq 2 iso 0 dist 9.40443 13.9608 7.82157 8.85995 8.32982 10.5401 numMergedOcc 0
34 mol 289 unq 0 iso 0 dist 9.40443 5.24841 5.44942 8.85995 8.32982 6.71401 numMergedOcc 0
35 mol 289 unq 1 iso 0 dist 9.40443 5.1508 8.53689 8.85995 8.32982 4.06127 numMergedOcc 0
36 mol 289 unq 2 iso 0 dist 9.40443 13.9608 7.82157 8.85995 8.32982 10.5401 numMergedOcc 0
