0 mol 24 unq 0 iso 0 dist 9.54519 12.1061 8.4051 6.53276 8.23446 14.1082 16.6394 10.1698 6.61696 16.1924 numMergedOcc 0
1 mol 24 unq 1 iso 0 dist 9.54519 12.1061 8.4051 6.53276 8.23446 14.1082 13.8227 13.6174 5.80953 17.4861 numMergedOcc 0
2 mol 24 unq 2 iso 0 dist 9.54519 12.1061 8.4051 6.81998 8.75662 9.62033 16.6394 10.1698 6.61696 15.3807 numMergedOcc 0
3 mol 24 unq 3 iso 0 dist 9.54519 12.1061 8.4051 6.81998 8.75662 9.62033 13.8227 13.6174 5.80953 11.7489 numMergedOcc 0
4 mol 24 unq 4 iso 0 dist 9.54519 6.53276 8.23446 12.1061 8.4051 14.1082 13.5933 5.73029 9.33304 13.2391 numMergedOcc 0
5 mol 24 unq 5 iso 0 dist 9.54519 6.53276 8.23446 12.1061 8.4051 14.1082 9.49646 6.28159 4.5711 12.3034 numMergedOcc 0
6 mol 24 unq 6 iso 0 dist 9.54519 6.53276 8.23446 12.1061 8.4051 14.1082 6.36381 5.50396 4.44526 9.84204 numMergedOcc 0
7 mol 24 unq 7 iso 0 dist 9.54519 6.53276 8.23446 6.81998 8.75662 11.342 13.5933 5.73029 9.33304 14.1221 numMergedOcc 0
8 mol 24 unq 8 iso 0 dist 9.54519 6.53276 8.23446 6.81998 8.75662 11.342 9.49646 6.28159 4.5711 12.6707 numMergedOcc 0
9 mol 24 unq 9 iso 0 dist 9.54519 6.53276 8.23446 6.81998 8.75662 11.342 6.36381 5.50396 4.44526 9.586 numMergedOcc 0
10 mol 24 unq 10 iso 0 dist 9.54519 6.81998 8.75662 12.1061 8.4051 9.62033 6.36381 5.50396 9.586 9.84204 numMergedOcc 0
11 mol 24 unq 11 iso 0 dist 9.54519 6.81998 8.75662 6.53276 8.23446 11.342 6.36381 5.50396 9.586 4.44526 numMergedOcc 0
12 mol 24 unq 12 iso 0 dist 6.11056 11.095 8.60554 4.04757 8.44664 14.1496 17.6238 14.8647 6.61696 20.4659 numMergedOcc 0
13 mol 24 unq 13 iso 0 dist 6.11056 11.095 8.60554 4.04757 8.44664 14.1496 10.4056 5.11636 5.80953 12.8213 numMergedOcc 0
14 mol 24 unq 14 iso 0 dist 6.11056 11.095 8.60554 6.66757 9.44691 9.62033 17.6238 14.8647 6.61696 15.3807 numMergedOcc 0
15 mol 24 unq 15 iso 0 dist 6.11056 11.095 8.60554 6.66757 9.44691 9.62033 10.4056 5.11636 5.80953 11.7489 numMergedOcc 0
16 mol 24 unq 16 iso 0 dist 6.11056 4.04757 8.44664 11.095 8.60554 14.1496 8.94703 4.79736 9.98592 13.0764 numMergedOcc 0
17 mol 24 unq 17 iso 0 dist 6.11056 4.04757 8.44664 6.66757 9.44691 10.4263 8.94703 4.79736 9.98592 13.2105 numMergedOcc 0
18 mol 24 unq 18 iso 0 dist 6.11056 6.66757 9.44691 11.095 8.60554 9.62033 15.2305 14.4081 9.586 9.84204 numMergedOcc 0
19 mol 24 unq 19 iso 0 dist 6.11056 6.66757 9.44691 4.04757 8.44664 10.4263 15.2305 14.4081 9.586 19.2261 numMergedOcc 0
20 mol 25 unq 0 iso 0 dist 8.40051 4.32173 6.16347 15.9662 7.92503 12.7398 5.77745 5.63212 5.20109 13.0308 numMergedOcc 0
21 mol 25 unq 1 iso 0 dist 8.6396 4.32173 7.45383 16.0077 9.01548 12.6805 5.77745 6.47509 5.20109 12.506 numMergedOcc 0
22 mol 113 unq 0 iso 0 dist 8.89481 11.2266 8.8822 9.01097 9.66219 4.09459 18.4602 13.9729 9.30645 10.6797 numMergedOcc 0
23 mol 129 unq 0 iso 0 dist 6.38163 4.92611 7.58957 7.03404 6.28565 7.91034 6.53559 6.28232 6.34626 10.9495 numMergedOcc 0
24 mol 143 unq 0 iso 0 dist 8.30654 11.6678 7.78652 11.347 8.91301 4.30566 12.027 4.78563 5.06564 7.5373 numMergedOcc 0
25 mol 143 unq 1 iso 0 dist 8.30654 11.347 8.91301 11.6678 7.78652 4.30566 12.027 4.78563 7.5373 5.06564 numMergedOcc 0
26 mol 159 unq 0 iso 0 dist 7.97007 6.69743 8.4858 4.49716 9.17787 7.73341 10.0117 4.48323 9.35202 12.5346 numMergedOcc 0
27 mol 195 unq 0 iso 0 dist 7.63036 7.14066 7.36683 4.58275 6.95086 9.90317 10.6446 5.41635 6.22742 10.8593 numMergedOcc 0
28 mol 212 unq 0 iso 0 dist 5.87223 6.48939 8.69988 9.39384 9.74144 12.5482 5.03184 3.9436 9.10288 12.0526 numMergedOcc 0
29 mol 212 unq 1 iso 0 dist 5.87223 6.48939 8.69988 5.81626 8.55903 6.18191 5.03184 3.9436 9.10288 6.19798 numMergedOcc 0
30 mol 212 unq 2 iso 0 dist 5.87223 6.48939 8.69988 5.94698 7.15603 7.34372 5.03184 3.9436 9.10288 9.32123 numMergedOcc 0
31 mol 212 unq 3 iso 0 dist 5.87223 5.81626 8.55903 9.39384 9.74144 15.0034 5.03184 3.9436 6.19798 12.0526 numMergedOcc 0
32 mol 212 unq 4 iso 0 dist 5.87223 5.81626 8.55903 6.48939 8.69988 6.18191 5.03184 3.9436 6.19798 9.10288 numMergedOcc 0
33 mol 212 unq 5 iso 0 dist 5.87223 5.81626 8.55903 5.94698 7.15603 10.7093 5.03184 3.9436 6.19798 9.32123 numMergedOcc 0
34 mol 212 unq 6 iso 0 dist 8.062 10.4595 8.69988 4.69067 9.74144 12.5482 11.3822 3.9436 9.10288 12.0526 numMergedOcc 0
35 mol 212 unq 7 iso 0 dist 8.062 10.4595 8.69988 14.0193 8.55903 6.18191 11.3822 3.9436 9.10288 6.19798 numMergedOcc 0
36 mol 212 unq 8 iso 0 dist 8.062 10.4595 8.69988 4.18086 7.15603 7.34372 11.3822 3.9436 9.10288 9.32123 numMergedOcc 0
37 mol 212 unq 9 iso 0 dist 8.062 14.0193 8.55903 4.69067 9.74144 15.0034 11.3822 3.9436 6.19798 12.0526 numMergedOcc 0
38 mol 212 unq 10 iso 0 dist 8.062 14.0193 8.55903 10.4595 8.69988 6.18191 11.3822 3.9436 6.19798 9.10288 numMergedOcc 0
39 mol 212 unq 11 iso 0 dist 8.062 14.0193 8.55903 4.18086 7.15603 10.7093 11.3822 3.9436 6.19798 9.32123 numMergedOcc 0
40 mol 212 unq 12 iso 0 dist 8.70011 8.87823 8.69988 5.37854 9.74144 12.5482 9.54676 3.9436 9.10288 12.0526 numMergedOcc 0
41 mol 212 unq 13 iso 0 dist 8.70011 8.87823 8.69988 10.7245 8.55903 6.18191 9.54676 3.9436 9.10288 6.19798 numMergedOcc 0
42 mol 212 unq 14 iso 0 dist 8.70011 8.87823 8.69988 3.74692 7.15603 7.34372 9.54676 3.9436 9.10288 9.32123 numMergedOcc 0
43 mol 212 unq 15 iso 0 dist 8.70011 10.7245 8.55903 5.37854 9.74144 15.0034 9.54676 3.9436 6.19798 12.0526 numMergedOcc 0
44 mol 212 unq 16 iso 0 dist 8.70011 10.7245 8.55903 8.87823 8.69988 6.18191 9.54676 3.9436 6.19798 9.10288 numMergedOcc 0
45 mol 212 unq 17 iso 0 dist 8.70011 10.7245 8.55903 3.74692 7.15603 10.7093 9.54676 3.9436 6.19798 9.32123 numMergedOcc 0
46 mol 222 unq 0 iso 0 dist 9.55777 12.979 7.67576 4.05539 9.82371 11.3283 15.2698 6.84862 8.43195 14.0832 numMergedOcc 0
47 mol 222 unq 1 iso 0 dist 9.55777 12.979 7.67576 4.05539 9.82371 11.3283 16.9252 9.53117 8.23406 14.9425 numMergedOcc 0
48 mol 234 unq 0 iso 0 dist 7.46434 11.1213 7.32499 6.06471 6.30154 10.0708 12.6209 13.1872 7.77911 14.1037 numMergedOcc 0
49 mol 234 unq 1 iso 0 dist 7.50424 10.6488 7.32499 11.2248 6.30154 10.0708 18.3012 13.1872 7.77911 14.1037 numMergedOcc 0
50 mol 274 unq 0 iso 0 dist 6.55855 6.70266 9.45514 5.15747 6.39866 10.7637 8.97249 12.393 7.77765 10.0206 numMergedOcc 0
51 mol 274 unq 1 iso 0 dist 6.55855 6.70266 9.45514 5.15747 6.39866 10.7637 4.97796 8.87855 9.65868 8.60027 numMergedOcc 0
52 mol 274 unq 2 iso 0 dist 6.55855 5.15747 6.39866 6.70266 9.45514 10.7637 4.97796 8.87855 8.60027 9.65868 numMergedOcc 0
