0 mol 24 unq 0 iso 0 dist 7.40392 8.15652 4.33963 8.56483 5.59311 9.75636 numMergedOcc 0
1 mol 34 unq 0 iso 0 dist 8.36524 8.8717 14.0576 7.66913 7.86199 12.5406 numMergedOcc 0
2 mol 68 unq 0 iso 0 dist 5.9651 5.94459 8.53692 8.44761 10.0743 13.7484 numMergedOcc 0
3 mol 68 unq 1 iso 0 dist 5.9651 5.94459 8.53692 6.81124 6.20057 11.9362 numMergedOcc 0
4 mol 70 unq 0 iso 0 dist 6.77833 4.67358 9.03317 6.13606 4.36555 8.68801 numMergedOcc 0
5 mol 70 unq 1 iso 0 dist 8.30653 9.33262 14.4239 5.76805 10.8634 8.75516 numMergedOcc 0
6 mol 70 unq 2 iso 0 dist 6.91739 9.33262 10.4473 5.76805 4.98521 8.75516 numMergedOcc 0
7 mol 85 unq 0 iso 0 dist 9.9795 8.82052 4.18004 5.20528 9.29301 9.16969 numMergedOcc 0
8 mol 92 unq 0 iso 0 dist 9.96446 7.05954 5.69731 6.15011 8.70803 8.0763 numMergedOcc 0
9 mol 92 unq 1 iso 0 dist 6.70686 7.05954 4.14907 6.15011 8.87994 8.0763 numMergedOcc 0
10 mol 112 unq 0 iso 0 dist 8.86938 5.9819 8.56707 8.65004 11.8396 5.91698 numMergedOcc 0
11 mol 112 unq 1 iso 0 dist 8.86938 5.9819 8.56707 9.86487 18.0868 15.0784 numMergedOcc 0
12 mol 112 unq 2 iso 0 dist 7.42474 5.9819 12.6695 8.65004 12.2656 5.91698 numMergedOcc 0
13 mol 112 unq 3 iso 0 dist 7.42474 5.9819 12.6695 9.86487 5.76986 15.0784 numMergedOcc 0
14 mol 133 unq 0 iso 0 dist 8.66715 8.37793 8.28698 9.29665 17.3196 13.6359 numMergedOcc 0
15 mol 133 unq 1 iso 0 dist 9.00172 8.37793 5.74088 9.29665 16.1302 13.6359 numMergedOcc 0
16 mol 154 unq 0 iso 0 dist 6.44195 6.03116 6.45768 8.85675 10.0639 10.4731 numMergedOcc 0
17 mol 154 unq 1 iso 0 dist 7.34207 6.03116 6.55507 8.85675 5.27847 10.4731 numMergedOcc 0
18 mol 186 unq 0 iso 0 dist 9.52413 6.59729 10.3944 8.34668 15.1778 6.71237 numMergedOcc 0
19 mol 186 unq 1 iso 0 dist 9.52413 6.59729 10.3944 8.76308 8.14815 5.91678 numMergedOcc 0
20 mol 209 unq 0 iso 0 dist 5.92907 9.95951 5.96694 9.17634 10.6456 12.4196 numMergedOcc 0
21 mol 209 unq 1 iso 0 dist 5.92907 6.43914 4.90038 9.17634 10.6456 12.5858 numMergedOcc 0
22 mol 214 unq 0 iso 0 dist 9.43611 9.11795 6.00534 6.90717 7.8472 7.29498 numMergedOcc 0
23 mol 230 unq 0 iso 0 dist 6.03738 6.47064 10.753 5.75445 6.17246 6.0456 numMergedOcc 0
24 mol 236 unq 0 iso 0 dist 8.95071 9.33359 7.00028 5.27184 9.52712 5.92456 numMergedOcc 0
25 mol 236 unq 1 iso 0 dist 8.95071 9.33359 7.00028 7.98527 9.82639 10.9807 numMergedOcc 0
26 mol 278 unq 0 iso 0 dist 9.91518 9.06043 6.54009 6.9592 14.3412 15.1214 numMergedOcc 0
27 mol 281 unq 0 iso 0 dist 9.27716 6.42743 13.9013 9.42297 11.6729 14.5663 numMergedOcc 0
28 mol 284 unq 0 iso 0 dist 9.98268 8.79958 11.8906 6.53769 15.3251 9.97867 numMergedOcc 0
29 mol 284 unq 1 iso 0 dist 6.83147 8.79958 6.4399 6.53769 10.6664 9.97867 numMergedOcc 0
30 mol 284 unq 2 iso 0 dist 7.43241 8.79958 13.016 6.53769 4.50325 9.97867 numMergedOcc 0
31 mol 287 unq 0 iso 0 dist 7.95849 9.79154 6.7501 8.25538 13.2859 10.8252 numMergedOcc 0
32 mol 288 unq 0 iso 0 dist 7.95849 9.79154 6.7501 8.25538 13.2859 10.8252 numMergedOcc 0
33 mol 289 unq 0 iso 0 dist 7.95849 9.79154 6.7501 8.25538 13.2859 10.8252 numMergedOcc 0
