0 mol 34 unq 0 iso 0 dist 7.18022 6.24711 3.39994 13.1004 9.41098 10.036 numMergedOcc 0
1 mol 72 unq 0 iso 0 dist 9.55118 9.10345 9.20237 16.024 8.80645 15.2524 numMergedOcc 0
2 mol 95 unq 0 iso 0 dist 8.27883 5.75428 6.27231 4.73066 4.3439 6.05855 numMergedOcc 0
3 mol 95 unq 1 iso 0 dist 8.27883 8.57395 11.734 4.73066 4.3439 11.1729 numMergedOcc 0
4 mol 95 unq 2 iso 0 dist 8.27883 9.85409 17.4304 4.73066 4.3439 14.5416 numMergedOcc 0
5 mol 95 unq 3 iso 0 dist 5.75428 8.27883 6.27231 4.73066 6.05855 4.3439 numMergedOcc 0
6 mol 95 unq 4 iso 0 dist 5.75428 8.57395 6.95874 4.73066 6.05855 11.1729 numMergedOcc 0
7 mol 95 unq 5 iso 0 dist 5.75428 9.85409 12.3063 4.73066 6.05855 14.5416 numMergedOcc 0
8 mol 98 unq 0 iso 0 dist 7.02507 5.92242 9.6331 9.71703 7.14813 14.5206 numMergedOcc 0
9 mol 112 unq 0 iso 0 dist 9.02706 9.39168 6.38762 6.35793 5.92828 9.1247 numMergedOcc 0
10 mol 112 unq 1 iso 0 dist 8.47988 8.0427 6.38762 4.69658 5.92828 9.1247 numMergedOcc 0
11 mol 112 unq 2 iso 0 dist 9.39168 9.02706 6.38762 6.35793 9.1247 5.92828 numMergedOcc 0
12 mol 112 unq 3 iso 0 dist 8.0427 8.47988 6.38762 4.69658 9.1247 5.92828 numMergedOcc 0
13 mol 134 unq 0 iso 0 dist 9.10524 6.42772 7.62195 14.9489 6.76852 10.725 numMergedOcc 0
14 mol 134 unq 1 iso 0 dist 5.35237 8.70621 6.05407 7.89899 4.94473 10.725 numMergedOcc 0
15 mol 134 unq 2 iso 0 dist 9.00918 7.99477 4.87973 9.39407 6.76852 4.94473 numMergedOcc 0
16 mol 134 unq 3 iso 0 dist 7.99477 9.00918 4.87973 9.39407 4.94473 6.76852 numMergedOcc 0
17 mol 142 unq 0 iso 0 dist 7.81207 7.18002 13.4681 4.05822 5.42679 11.1832 numMergedOcc 0
18 mol 143 unq 0 iso 0 dist 5.40637 7.36975 10.1474 6.75249 6.60366 11.7801 numMergedOcc 0
19 mol 152 unq 0 iso 0 dist 6.59889 8.9192 3.55572 10.6994 8.60651 11.544 numMergedOcc 0
20 mol 162 unq 0 iso 0 dist 7.37333 7.45998 3.77838 4.68369 8.91326 8.33649 numMergedOcc 0
21 mol 162 unq 1 iso 0 dist 7.45998 7.37333 3.77838 4.68369 8.33649 8.91326 numMergedOcc 0
22 mol 184 unq 0 iso 0 dist 5.96423 8.97589 5.33725 5.03539 5.23187 9.72476 numMergedOcc 0
23 mol 186 unq 0 iso 0 dist 7.2793 9.51091 3.47886 4.04122 9.34653 10.8711 numMergedOcc 0
24 mol 186 unq 1 iso 0 dist 7.2793 7.85184 12.5618 4.04122 9.34653 10.8716 numMergedOcc 0
25 mol 222 unq 0 iso 0 dist 5.56538 7.48954 3.58181 8.89157 8.88902 9.83916 numMergedOcc 0
26 mol 222 unq 1 iso 0 dist 6.74196 8.36842 8.10209 5.17002 9.79673 12.7094 numMergedOcc 0
27 mol 222 unq 2 iso 0 dist 6.74196 8.36842 8.10209 6.70898 6.39673 7.80676 numMergedOcc 0
28 mol 222 unq 3 iso 0 dist 6.74196 9.75472 9.49218 5.17002 9.79673 14.6983 numMergedOcc 0
29 mol 222 unq 4 iso 0 dist 6.74196 9.75472 9.49218 6.70898 6.39673 10.9266 numMergedOcc 0
30 mol 222 unq 5 iso 0 dist 8.36842 6.74196 8.10209 6.70898 7.80676 6.39673 numMergedOcc 0
31 mol 222 unq 6 iso 0 dist 8.36842 9.75472 3.53707 6.70898 7.80676 10.9266 numMergedOcc 0
32 mol 225 unq 0 iso 0 dist 6.50998 9.09424 8.05944 9.72811 8.74463 13.862 numMergedOcc 0
33 mol 225 unq 1 iso 0 dist 6.50998 8.14831 13.7858 9.72811 8.74463 15.4089 numMergedOcc 0
34 mol 235 unq 0 iso 0 dist 6.29377 8.19317 4.8835 3.99115 8.60314 11.7605 numMergedOcc 0
35 mol 235 unq 1 iso 0 dist 5.70635 5.1823 4.8835 10.0427 8.60314 11.7605 numMergedOcc 0
