0 mol 7 unq 0 iso 0 dist 9.67498 15.0231 9.85726 17.8527 10.4879 7.32392 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 9.32945 17.302 9.85726 15.7555 10.4879 7.32392 numMergedOcc 0
2 mol 14 unq 0 iso 0 dist 7.66311 4.15151 8.39221 8.88058 6.09608 6.89209 numMergedOcc 0
3 mol 16 unq 0 iso 0 dist 7.88676 6.06561 8.67719 11.7065 9.57729 6.84569 numMergedOcc 0
4 mol 61 unq 0 iso 0 dist 8.30431 6.32949 9.62468 10.2903 14.0458 9.70415 numMergedOcc 0
5 mol 61 unq 1 iso 0 dist 4.628 6.32949 5.92705 10.2903 6.47853 9.70415 numMergedOcc 0
6 mol 98 unq 0 iso 0 dist 9.35633 16.255 9.59261 10.4739 6.14241 5.85841 numMergedOcc 0
7 mol 98 unq 1 iso 0 dist 9.35633 16.255 9.59261 13.6924 10.8152 6.78839 numMergedOcc 0
8 mol 98 unq 2 iso 0 dist 9.35633 9.75148 6.67936 10.4739 6.14241 7.00285 numMergedOcc 0
9 mol 98 unq 3 iso 0 dist 9.35633 9.75148 6.67936 13.6924 10.8152 8.02354 numMergedOcc 0
10 mol 102 unq 0 iso 0 dist 5.43401 7.49575 9.10229 11.8703 12.6508 9.84673 numMergedOcc 0
11 mol 109 unq 0 iso 0 dist 8.59182 12.4009 8.21889 12.4161 5.07258 7.51061 numMergedOcc 0
12 mol 111 unq 0 iso 0 dist 8.83191 13.3198 8.42147 21.1761 13.7393 9.04546 numMergedOcc 0
13 mol 181 unq 0 iso 0 dist 6.47689 4.681 6.43406 11.7878 6.31839 9.18245 numMergedOcc 0
14 mol 210 unq 0 iso 0 dist 6.24111 13.3929 9.67457 20.8016 17.7409 8.71409 numMergedOcc 0
15 mol 210 unq 1 iso 0 dist 9.00343 12.3088 9.67457 18.654 17.7409 8.71409 numMergedOcc 0
16 mol 210 unq 2 iso 0 dist 6.41444 13.3774 9.67457 21.963 17.7409 8.71409 numMergedOcc 0
17 mol 220 unq 0 iso 0 dist 7.57712 6.19375 7.31105 12.1736 9.98645 6.21273 numMergedOcc 0
18 mol 224 unq 0 iso 0 dist 7.62593 11.4653 9.33771 18.4903 13.9782 9.73411 numMergedOcc 0
19 mol 224 unq 1 iso 0 dist 7.62593 11.4653 9.33771 14.1813 14.788 7.07564 numMergedOcc 0
20 mol 231 unq 0 iso 0 dist 7.28719 10.9863 7.79865 18.4635 14.3729 8.91036 numMergedOcc 0
21 mol 231 unq 1 iso 0 dist 6.60684 8.54452 7.79865 17.0912 14.3729 8.91036 numMergedOcc 0
22 mol 238 unq 0 iso 0 dist 5.57184 9.76195 6.83152 11.4755 7.10888 6.06422 numMergedOcc 0
23 mol 238 unq 1 iso 0 dist 5.57184 7.01206 5.24313 10.5902 12.2489 7.64276 numMergedOcc 0
24 mol 249 unq 0 iso 0 dist 6.18866 6.28944 5.78121 9.39819 7.82195 7.72708 numMergedOcc 0
25 mol 258 unq 0 iso 0 dist 8.97411 4.6881 5.73296 5.04068 9.93782 8.40766 numMergedOcc 0
26 mol 258 unq 1 iso 0 dist 7.70189 9.78068 8.58088 11.8229 7.42035 8.9706 numMergedOcc 0
27 mol 265 unq 0 iso 0 dist 9.56472 15.3912 9.72927 11.4757 4.3101 8.57445 numMergedOcc 0
28 mol 265 unq 1 iso 0 dist 9.50814 6.35501 9.72927 10.8833 4.3101 8.57445 numMergedOcc 0
29 mol 274 unq 0 iso 0 dist 9.07452 6.11218 7.80446 6.08059 5.44831 8.30175 numMergedOcc 0
30 mol 274 unq 1 iso 0 dist 7.21004 6.11218 9.91395 6.08059 9.91966 8.30175 numMergedOcc 0
31 mol 274 unq 2 iso 0 dist 6.12202 7.23876 9.02749 8.04439 4.84163 6.36173 numMergedOcc 0
32 mol 274 unq 3 iso 0 dist 6.44266 6.98398 7.80446 10.2998 5.44831 8.30175 numMergedOcc 0
33 mol 274 unq 4 iso 0 dist 8.75703 6.98398 9.91395 10.2998 9.91966 8.30175 numMergedOcc 0
34 mol 277 unq 0 iso 0 dist 8.81903 5.28949 6.60309 13.1115 5.76075 8.82899 numMergedOcc 0
35 mol 278 unq 0 iso 0 dist 8.87405 8.66976 9.82774 16.7318 14.331 8.83775 numMergedOcc 0
