0 mol 7 unq 0 iso 0 dist 8.75465 5.8785 8.36111 8.00249 4.80709 5.99898 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 8.00249 5.8785 5.99898 8.75465 4.80709 8.36111 numMergedOcc 0
2 mol 47 unq 0 iso 0 dist 9.43156 5.76297 9.66404 6.75437 3.76917 7.75282 numMergedOcc 0
3 mol 47 unq 1 iso 0 dist 6.75437 5.76297 7.75282 9.43156 3.76917 9.66404 numMergedOcc 0
4 mol 48 unq 0 iso 0 dist 9.99971 5.93639 5.55714 10.9776 3.4604 7.39468 numMergedOcc 0
5 mol 48 unq 1 iso 0 dist 9.99971 5.93639 5.55714 12.2305 5.16888 9.85287 numMergedOcc 0
6 mol 56 unq 0 iso 0 dist 7.07124 6.3873 5.91948 12.5135 6.59528 7.89184 numMergedOcc 0
7 mol 72 unq 0 iso 0 dist 9.20886 5.50284 5.49421 11.3204 5.75711 8.16985 numMergedOcc 0
8 mol 72 unq 1 iso 0 dist 9.20886 5.50284 5.49421 12.3271 5.26077 7.81344 numMergedOcc 0
9 mol 109 unq 0 iso 0 dist 8.59103 11.3918 9.05604 10.3079 7.49425 5.58623 numMergedOcc 0
10 mol 160 unq 0 iso 0 dist 8.27864 14.004 9.78028 10.2669 3.74754 9.36505 numMergedOcc 0
11 mol 186 unq 0 iso 0 dist 9.00537 13.8548 7.12029 14.8602 6.09215 8.56602 numMergedOcc 0
12 mol 186 unq 1 iso 0 dist 8.9388 12.2795 7.12029 11.1116 6.09215 8.56602 numMergedOcc 0
13 mol 207 unq 0 iso 0 dist 7.25953 11.2345 8.01415 9.05688 6.07936 8.25861 numMergedOcc 0
14 mol 207 unq 1 iso 0 dist 7.25953 11.2345 8.01415 11.8798 10.1734 8.5067 numMergedOcc 0
15 mol 207 unq 2 iso 0 dist 9.05688 11.3486 9.3 11.8798 4.66347 6.76443 numMergedOcc 0
16 mol 207 unq 3 iso 0 dist 9.05688 11.3486 9.3 11.7741 4.80478 9.14701 numMergedOcc 0
17 mol 207 unq 4 iso 0 dist 9.05688 11.2345 8.25861 7.25953 6.07936 8.01415 numMergedOcc 0
18 mol 207 unq 5 iso 0 dist 9.05688 11.2345 8.25861 11.8798 4.66347 8.5067 numMergedOcc 0
19 mol 217 unq 0 iso 0 dist 9.41353 5.68697 6.72624 8.28155 6.12994 4.92885 numMergedOcc 0
20 mol 217 unq 1 iso 0 dist 8.28155 5.68697 4.92885 9.41353 6.12994 6.72624 numMergedOcc 0
21 mol 240 unq 0 iso 0 dist 7.78879 5.01224 5.53403 12.4979 9.03257 9.42898 numMergedOcc 0
22 mol 243 unq 0 iso 0 dist 5.78671 5.85313 8.48003 5.46817 4.09189 5.54003 numMergedOcc 0
23 mol 243 unq 1 iso 0 dist 5.46817 5.85313 5.54003 5.78671 4.09189 8.48003 numMergedOcc 0
24 mol 260 unq 0 iso 0 dist 6.79386 5.14726 9.68232 6.19564 3.64495 8.29663 numMergedOcc 0
25 mol 260 unq 1 iso 0 dist 6.19564 5.14726 8.29663 6.79386 3.64495 9.68232 numMergedOcc 0
26 mol 274 unq 0 iso 0 dist 9.61255 5.67354 9.40401 12.7686 8.77585 9.00595 numMergedOcc 0
