0 mol 4 unq 0 iso 0 dist 9.15878 10.6508 9.12428 4.01547 7.29079 11.2087 numMergedOcc 0
1 mol 5 unq 0 iso 0 dist 8.70824 11.97 9.17088 3.67097 6.86923 12.5321 numMergedOcc 0
2 mol 26 unq 0 iso 0 dist 5.73363 10.009 6.12361 4.10415 9.54171 12.4679 numMergedOcc 0
3 mol 73 unq 0 iso 0 dist 6.69184 8.59095 7.23812 12.7379 7.9575 15.0358 numMergedOcc 0
4 mol 73 unq 1 iso 0 dist 6.69184 6.90539 5.36012 12.7379 7.9575 6.28792 numMergedOcc 0
5 mol 154 unq 0 iso 0 dist 8.65008 5.5065 6.36439 11.9194 8.76245 10.3287 numMergedOcc 0
6 mol 158 unq 0 iso 0 dist 8.80952 6.84127 9.99005 3.72916 7.76952 3.45021 numMergedOcc 0
7 mol 158 unq 1 iso 0 dist 8.80952 6.84127 9.99005 17.8569 9.98554 18.84 numMergedOcc 0
8 mol 167 unq 0 iso 0 dist 9.63473 12.9803 9.23645 3.86842 7.84707 9.18876 numMergedOcc 0
9 mol 167 unq 1 iso 0 dist 8.39087 6.32863 9.23645 3.72502 7.84707 9.18876 numMergedOcc 0
10 mol 168 unq 0 iso 0 dist 5.60956 6.59758 8.41715 3.56227 5.64732 3.42733 numMergedOcc 0
11 mol 168 unq 1 iso 0 dist 5.60956 6.59758 8.41715 3.96437 5.52214 8.91606 numMergedOcc 0
12 mol 168 unq 2 iso 0 dist 5.60956 6.59758 8.41715 6.15982 5.80055 11.8148 numMergedOcc 0
13 mol 168 unq 3 iso 0 dist 5.60956 6.59758 8.41715 5.33789 7.44481 11.886 numMergedOcc 0
14 mol 168 unq 4 iso 0 dist 5.60956 5.81821 7.79893 3.56227 5.64732 6.57536 numMergedOcc 0
15 mol 168 unq 5 iso 0 dist 5.60956 5.81821 7.79893 3.96437 5.52214 4.07587 numMergedOcc 0
16 mol 168 unq 6 iso 0 dist 5.60956 5.81821 7.79893 6.15982 5.80055 10.612 numMergedOcc 0
17 mol 168 unq 7 iso 0 dist 5.60956 5.81821 7.79893 5.33789 7.44481 9.28226 numMergedOcc 0
18 mol 205 unq 0 iso 0 dist 5.81277 4.78067 6.23932 3.83801 9.21286 7.35363 numMergedOcc 0
19 mol 205 unq 1 iso 0 dist 5.05912 4.2475 6.23932 9.4797 9.21286 7.35363 numMergedOcc 0
20 mol 205 unq 2 iso 0 dist 6.60429 6.8901 6.23932 13.314 9.21286 7.35363 numMergedOcc 0
21 mol 239 unq 0 iso 0 dist 4.53228 8.37622 7.78671 6.29809 5.4687 6.79067 numMergedOcc 0
22 mol 239 unq 1 iso 0 dist 8.54078 5.55494 7.78671 8.19053 5.4687 6.79067 numMergedOcc 0
23 mol 258 unq 0 iso 0 dist 8.27336 5.79034 8.23381 8.73681 6.90511 4.02333 numMergedOcc 0
24 mol 265 unq 0 iso 0 dist 8.5774 4.39816 6.45326 8.80592 6.04835 5.46481 numMergedOcc 0
25 mol 265 unq 1 iso 0 dist 9.94957 10.4948 6.45326 14.366 6.04835 5.46481 numMergedOcc 0
26 mol 265 unq 2 iso 0 dist 8.01664 7.73011 6.45326 11.7178 6.04835 5.46481 numMergedOcc 0
27 mol 271 unq 0 iso 0 dist 6.96986 8.72109 9.42899 5.67979 9.97897 10.1601 numMergedOcc 0
28 mol 274 unq 0 iso 0 dist 7.8547 4.4049 8.41236 11.1514 8.82003 7.88913 numMergedOcc 0
