0 mol 25 unq 0 iso 0 dist 9.27448 5.46378 6.674 8.69224 7.60393 4.60034 numMergedOcc 0
1 mol 25 unq 1 iso 0 dist 9.07927 5.46378 8.43188 8.69224 7.23535 4.60034 numMergedOcc 0
2 mol 25 unq 2 iso 0 dist 8.50987 5.46378 10.3635 8.69224 9.92243 4.60034 numMergedOcc 0
3 mol 42 unq 0 iso 0 dist 9.82536 8.00967 9.14254 7.73997 4.50835 4.74211 numMergedOcc 0
4 mol 42 unq 1 iso 0 dist 8.77998 8.00967 8.61772 7.73997 4.98339 4.74211 numMergedOcc 0
5 mol 61 unq 0 iso 0 dist 8.46313 9.01453 8.17831 9.02073 9.76892 5.27645 numMergedOcc 0
6 mol 76 unq 0 iso 0 dist 9.79714 6.89859 7.18506 9.06957 15.7682 9.82878 numMergedOcc 0
7 mol 88 unq 0 iso 0 dist 8.71603 7.44647 5.37521 5.43098 4.47193 3.77436 numMergedOcc 0
8 mol 88 unq 1 iso 0 dist 8.71603 7.44647 5.37521 9.40555 12.8972 8.38696 numMergedOcc 0
9 mol 90 unq 0 iso 0 dist 7.37255 8.3399 13.469 5.52904 4.79453 9.69029 numMergedOcc 0
10 mol 98 unq 0 iso 0 dist 9.58693 7.00373 12.0313 5.61418 9.53244 12.2295 numMergedOcc 0
11 mol 98 unq 1 iso 0 dist 9.48388 7.00373 11.2452 5.61418 11.115 12.2295 numMergedOcc 0
12 mol 101 unq 0 iso 0 dist 8.23251 8.18846 5.91528 9.26699 8.69708 4.59758 numMergedOcc 0
13 mol 101 unq 1 iso 0 dist 7.42893 8.18846 9.37614 9.26699 7.89838 4.59758 numMergedOcc 0
14 mol 113 unq 0 iso 0 dist 9.80191 7.77845 8.69934 6.38269 6.54263 5.09579 numMergedOcc 0
15 mol 113 unq 1 iso 0 dist 9.80191 7.77845 8.69934 7.11196 3.92558 5.46299 numMergedOcc 0
16 mol 220 unq 0 iso 0 dist 4.71754 5.44212 6.02939 7.39043 3.57917 9.1398 numMergedOcc 0
17 mol 225 unq 0 iso 0 dist 9.30186 8.23463 7.12954 9.02494 14.2198 10.2743 numMergedOcc 0
18 mol 225 unq 1 iso 0 dist 9.30186 8.23463 7.12954 8.83641 17.4586 15.7461 numMergedOcc 0
19 mol 225 unq 2 iso 0 dist 6.51997 8.23463 11.8629 9.02494 9.76678 10.2743 numMergedOcc 0
20 mol 225 unq 3 iso 0 dist 6.51997 8.23463 11.8629 8.83641 5.41981 15.7461 numMergedOcc 0
21 mol 264 unq 0 iso 0 dist 8.43682 6.61098 10.8409 8.26228 10.1415 3.93329 numMergedOcc 0
22 mol 264 unq 1 iso 0 dist 6.20796 6.61098 10.5617 8.26228 11.5587 3.93329 numMergedOcc 0
23 mol 266 unq 0 iso 0 dist 8.82941 8.93824 13.7607 7.51951 13.1885 11.6746 numMergedOcc 0
24 mol 266 unq 1 iso 0 dist 8.82941 6.1432 4.27792 7.51951 13.1885 11.7541 numMergedOcc 0
