0 mol 7 unq 0 iso 0 dist 8.88982 4.24307 9.8603 14.92 8.72114 15.8072 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 8.8576 4.44694 5.51421 8.401 5.99972 4.60206 numMergedOcc 0
2 mol 24 unq 0 iso 0 dist 6.80849 4.98987 6.11056 14.1707 8.60554 11.095 numMergedOcc 0
3 mol 24 unq 1 iso 0 dist 6.80849 4.98987 6.11056 6.3045 8.44664 4.04757 numMergedOcc 0
4 mol 24 unq 2 iso 0 dist 6.80849 4.98987 6.11056 9.47767 9.44691 6.66757 numMergedOcc 0
5 mol 25 unq 0 iso 0 dist 6.00307 8.65485 8.40051 6.03478 6.16347 4.32173 numMergedOcc 0
6 mol 25 unq 1 iso 0 dist 6.00307 8.65485 8.40051 9.60684 7.92503 15.9662 numMergedOcc 0
7 mol 41 unq 0 iso 0 dist 9.02927 10.7868 5.41493 11.098 8.51663 4.08339 numMergedOcc 0
8 mol 43 unq 0 iso 0 dist 8.47617 12.345 8.38387 12.8271 8.95682 7.13085 numMergedOcc 0
9 mol 54 unq 0 iso 0 dist 6.13476 10.5752 5.97635 9.53962 7.21717 11.5332 numMergedOcc 0
10 mol 62 unq 0 iso 0 dist 9.58156 11.1016 8.1599 6.71938 4.74544 7.46975 numMergedOcc 0
11 mol 62 unq 1 iso 0 dist 7.59416 7.04908 8.1599 6.76473 4.74544 7.46975 numMergedOcc 0
12 mol 65 unq 0 iso 0 dist 9.75927 4.24391 8.76461 4.37601 6.72639 6.59475 numMergedOcc 0
13 mol 65 unq 1 iso 0 dist 9.75927 4.24391 8.76461 9.13935 9.34791 11.8419 numMergedOcc 0
14 mol 98 unq 0 iso 0 dist 4.31067 9.91645 5.9747 9.0917 6.65501 7.43001 numMergedOcc 0
15 mol 98 unq 1 iso 0 dist 4.31067 7.54723 4.50572 9.0917 6.65501 9.5305 numMergedOcc 0
16 mol 113 unq 0 iso 0 dist 8.29529 6.68968 8.89481 5.89952 8.8822 11.2266 numMergedOcc 0
17 mol 113 unq 1 iso 0 dist 8.29529 6.68968 8.89481 5.58964 9.66219 9.01097 numMergedOcc 0
18 mol 122 unq 0 iso 0 dist 8.054 4.79314 6.78949 5.97096 8.88537 4.21285 numMergedOcc 0
19 mol 122 unq 1 iso 0 dist 8.054 4.79314 6.78949 4.4646 9.23819 6.93382 numMergedOcc 0
20 mol 122 unq 2 iso 0 dist 8.054 5.45124 9.40018 4.4646 9.23819 4.81033 numMergedOcc 0
21 mol 122 unq 3 iso 0 dist 8.054 5.45124 9.40018 5.97096 8.88537 9.33734 numMergedOcc 0
22 mol 133 unq 0 iso 0 dist 6.29975 7.49664 9.3894 5.42142 6.66772 11.5759 numMergedOcc 0
23 mol 196 unq 0 iso 0 dist 7.23126 15.4605 8.79558 7.68725 6.86319 11.4857 numMergedOcc 0
24 mol 196 unq 1 iso 0 dist 7.82805 15.4921 8.79558 9.74385 6.86319 11.4857 numMergedOcc 0
25 mol 206 unq 0 iso 0 dist 7.94694 16.3384 9.36079 8.91883 6.16414 10.9922 numMergedOcc 0
26 mol 206 unq 1 iso 0 dist 7.94694 16.3384 9.36079 8.83227 7.33701 9.89331 numMergedOcc 0
27 mol 206 unq 2 iso 0 dist 7.94694 16.3384 9.36079 10.6714 8.0871 8.83984 numMergedOcc 0
28 mol 206 unq 3 iso 0 dist 7.94694 13.2408 7.42904 8.91883 6.16414 8.16827 numMergedOcc 0
29 mol 206 unq 4 iso 0 dist 7.94694 13.2408 7.42904 8.83227 7.33701 6.06766 numMergedOcc 0
30 mol 206 unq 5 iso 0 dist 7.94694 13.2408 7.42904 10.6714 8.0871 5.82916 numMergedOcc 0
31 mol 212 unq 0 iso 0 dist 8.13678 4.46198 5.87223 12.4498 9.74144 9.39384 numMergedOcc 0
32 mol 212 unq 1 iso 0 dist 8.13678 4.46198 5.87223 10.0809 8.69988 6.48939 numMergedOcc 0
33 mol 212 unq 2 iso 0 dist 8.13678 4.46198 5.87223 6.27773 8.55903 5.81626 numMergedOcc 0
34 mol 212 unq 3 iso 0 dist 8.13678 4.46198 5.87223 10.1594 7.15603 5.94698 numMergedOcc 0
35 mol 212 unq 4 iso 0 dist 8.13678 13.3406 8.062 12.4498 9.74144 4.69067 numMergedOcc 0
36 mol 212 unq 5 iso 0 dist 8.13678 13.3406 8.062 10.0809 8.69988 10.4595 numMergedOcc 0
37 mol 212 unq 6 iso 0 dist 8.13678 13.3406 8.062 6.27773 8.55903 14.0193 numMergedOcc 0
38 mol 212 unq 7 iso 0 dist 8.13678 13.3406 8.062 10.1594 7.15603 4.18086 numMergedOcc 0
39 mol 212 unq 8 iso 0 dist 8.13678 8.4881 8.70011 12.4498 9.74144 5.37854 numMergedOcc 0
40 mol 212 unq 9 iso 0 dist 8.13678 8.4881 8.70011 10.0809 8.69988 8.87823 numMergedOcc 0
41 mol 212 unq 10 iso 0 dist 8.13678 8.4881 8.70011 6.27773 8.55903 10.7245 numMergedOcc 0
42 mol 212 unq 11 iso 0 dist 8.13678 8.4881 8.70011 10.1594 7.15603 3.74692 numMergedOcc 0
43 mol 235 unq 0 iso 0 dist 8.84872 7.44501 9.11256 9.6662 9.55668 3.93066 numMergedOcc 0
44 mol 235 unq 1 iso 0 dist 8.84872 10.7196 7.08539 9.6662 9.55668 13.0408 numMergedOcc 0
45 mol 265 unq 0 iso 0 dist 7.83102 9.76011 7.04833 4.40079 6.71375 10.7881 numMergedOcc 0
46 mol 292 unq 0 iso 0 dist 8.99442 15.1745 9.6898 8.70711 7.83341 7.31058 numMergedOcc 0
47 mol 292 unq 1 iso 0 dist 8.99442 4.09108 5.75596 8.70711 7.83341 8.07013 numMergedOcc 0
