0 mol 4 unq 0 iso 0 dist 7.53929 8.60134 3.25279 9.82659 9.80438 8.68164 numMergedOcc 0
1 mol 11 unq 0 iso 0 dist 9.42607 5.59847 5.23547 13.2938 9.07476 9.89425 numMergedOcc 0
2 mol 11 unq 1 iso 0 dist 6.20956 5.59847 6.74026 4.4067 6.09937 9.32171 numMergedOcc 0
3 mol 18 unq 0 iso 0 dist 6.45965 8.1133 10.8265 6.54236 8.02671 14.2891 numMergedOcc 0
4 mol 18 unq 1 iso 0 dist 6.45965 8.1133 10.8265 4.86477 6.09533 12.7664 numMergedOcc 0
5 mol 18 unq 2 iso 0 dist 6.45965 8.44727 3.91445 6.54236 8.02671 11.743 numMergedOcc 0
6 mol 18 unq 3 iso 0 dist 6.45965 8.44727 3.91445 4.86477 6.09533 9.46349 numMergedOcc 0
7 mol 20 unq 0 iso 0 dist 8.67226 8.98326 4.76485 9.00405 7.17695 4.36087 numMergedOcc 0
8 mol 20 unq 1 iso 0 dist 8.67226 8.98326 4.76485 7.86889 9.33207 7.09639 numMergedOcc 0
9 mol 68 unq 0 iso 0 dist 9.073 6.09085 6.4113 11.023 8.18214 5.64092 numMergedOcc 0
10 mol 69 unq 0 iso 0 dist 9.34288 7.40698 4.69809 11.2122 5.75135 9.08745 numMergedOcc 0
11 mol 93 unq 0 iso 0 dist 4.45006 7.49235 3.91263 7.76629 5.10693 6.67678 numMergedOcc 0
12 mol 93 unq 1 iso 0 dist 4.45006 7.49235 3.91263 8.52218 6.58814 7.24956 numMergedOcc 0
13 mol 93 unq 2 iso 0 dist 4.45006 7.49235 3.91263 3.83191 6.13459 8.28591 numMergedOcc 0
14 mol 93 unq 3 iso 0 dist 4.45006 7.49235 3.91263 3.77555 7.54391 9.40687 numMergedOcc 0
15 mol 93 unq 4 iso 0 dist 4.45006 7.19431 5.59024 7.76629 5.10693 10.4903 numMergedOcc 0
16 mol 93 unq 5 iso 0 dist 4.45006 7.19431 5.59024 8.52218 6.58814 11.5899 numMergedOcc 0
17 mol 93 unq 6 iso 0 dist 4.45006 7.19431 5.59024 3.83191 6.13459 5.35008 numMergedOcc 0
18 mol 93 unq 7 iso 0 dist 4.45006 7.19431 5.59024 3.77555 7.54391 8.84576 numMergedOcc 0
19 mol 122 unq 0 iso 0 dist 8.3907 6.91978 3.65582 12.1473 6.80798 10.2878 numMergedOcc 0
20 mol 128 unq 0 iso 0 dist 7.4738 6.78833 6.84628 9.10228 5.38983 10.88 numMergedOcc 0
21 mol 128 unq 1 iso 0 dist 8.88867 6.78833 8.84157 9.10228 8.46801 10.88 numMergedOcc 0
22 mol 154 unq 0 iso 0 dist 9.71025 8.59532 7.4198 5.71332 8.26128 10.4142 numMergedOcc 0
23 mol 169 unq 0 iso 0 dist 8.11268 9.70796 14.9735 7.64279 7.33643 8.93091 numMergedOcc 0
24 mol 169 unq 1 iso 0 dist 9.19569 8.89822 7.0638 12.9917 9.58901 4.11374 numMergedOcc 0
25 mol 186 unq 0 iso 0 dist 6.22466 8.9388 3.6848 9.09753 6.99587 9.17458 numMergedOcc 0
26 mol 186 unq 1 iso 0 dist 6.22466 8.9388 3.6848 6.7472 4.37577 7.36794 numMergedOcc 0
27 mol 205 unq 0 iso 0 dist 8.95136 9.71147 11.9786 3.30102 8.87165 11.0548 numMergedOcc 0
28 mol 205 unq 1 iso 0 dist 8.95136 6.32553 10.0544 3.30102 8.87165 4.97301 numMergedOcc 0
29 mol 220 unq 0 iso 0 dist 4.17978 7.71199 4.94998 5.32983 8.60252 11.213 numMergedOcc 0
30 mol 239 unq 0 iso 0 dist 9.27632 6.95744 5.59638 3.68745 8.53092 7.97504 numMergedOcc 0
31 mol 260 unq 0 iso 0 dist 7.46 6.79386 9.22751 8.71923 7.88108 14.1902 numMergedOcc 0
32 mol 260 unq 1 iso 0 dist 7.46 6.79386 9.22751 9.96926 9.46576 10.8041 numMergedOcc 0
33 mol 260 unq 2 iso 0 dist 7.46 6.19564 6.73886 8.71923 7.88108 11.5762 numMergedOcc 0
34 mol 260 unq 3 iso 0 dist 7.46 6.19564 6.73886 9.96926 9.46576 7.49606 numMergedOcc 0
35 mol 285 unq 0 iso 0 dist 5.77107 7.12723 8.02755 5.32175 5.28731 11.2031 numMergedOcc 0
