0 mol 76 unq 0 iso 0 dist 8.83 7.60115 8.09199 10.1361 7.47794 8.17321 numMergedOcc 0
1 mol 76 unq 0 iso 1 dist 8.83 10.1361 7.47794 7.60115 8.09199 8.17321 numMergedOcc 0
2 mol 90 unq 0 iso 0 dist 4.75701 5.13128 9.44078 4.14427 5.9179 5.37245 numMergedOcc 0
3 mol 90 unq 0 iso 1 dist 4.75701 4.14427 5.9179 5.13128 9.44078 5.37245 numMergedOcc 0
4 mol 90 unq 1 iso 0 dist 9.89618 9.88666 9.44078 10.1669 5.9179 5.37245 numMergedOcc 0
5 mol 90 unq 1 iso 1 dist 9.89618 10.1669 5.9179 9.88666 9.44078 5.37245 numMergedOcc 0
6 mol 98 unq 0 iso 0 dist 4.31067 9.91645 5.9747 7.54723 4.50572 4.24815 numMergedOcc 0
7 mol 98 unq 0 iso 1 dist 4.31067 7.54723 4.50572 9.91645 5.9747 4.24815 numMergedOcc 0
8 mol 110 unq 0 iso 0 dist 8.1306 6.9318 9.73174 4.29339 9.65418 4.37555 numMergedOcc 0
9 mol 110 unq 0 iso 1 dist 8.1306 4.29339 9.65418 6.9318 9.73174 4.37555 numMergedOcc 0
10 mol 122 unq 0 iso 0 dist 8.054 4.79314 6.78949 5.45124 9.40018 9.50688 numMergedOcc 0
11 mol 122 unq 0 iso 1 dist 8.054 5.45124 9.40018 4.79314 6.78949 9.50688 numMergedOcc 0
12 mol 167 unq 0 iso 0 dist 9.21386 3.93619 8.14096 9.74898 8.43038 11.1234 numMergedOcc 0
13 mol 167 unq 0 iso 1 dist 9.21386 9.74898 8.43038 3.93619 8.14096 11.1234 numMergedOcc 0
14 mol 167 unq 1 iso 0 dist 9.21386 3.93619 8.14096 10.8657 9.87966 13.0523 numMergedOcc 0
15 mol 167 unq 1 iso 1 dist 9.21386 10.8657 9.87966 3.93619 8.14096 13.0523 numMergedOcc 0
16 mol 167 unq 1 iso 0 dist 9.21386 9.74898 8.43038 10.8657 9.87966 3.81938 numMergedOcc 0
17 mol 167 unq 1 iso 1 dist 9.21386 10.8657 9.87966 9.74898 8.43038 3.81938 numMergedOcc 0
18 mol 206 unq 0 iso 0 dist 7.94694 16.3384 9.36079 13.2408 7.42904 3.85697 numMergedOcc 0
19 mol 206 unq 0 iso 1 dist 7.94694 13.2408 7.42904 16.3384 9.36079 3.85697 numMergedOcc 0
20 mol 212 unq 0 iso 0 dist 8.13678 4.46198 5.87223 13.3406 8.062 9.449 numMergedOcc 0
21 mol 212 unq 0 iso 1 dist 8.13678 13.3406 8.062 4.46198 5.87223 9.449 numMergedOcc 0
22 mol 212 unq 1 iso 0 dist 8.13678 4.46198 5.87223 8.4881 8.70011 5.23375 numMergedOcc 0
23 mol 212 unq 1 iso 1 dist 8.13678 8.4881 8.70011 4.46198 5.87223 5.23375 numMergedOcc 0
24 mol 212 unq 1 iso 0 dist 8.13678 13.3406 8.062 8.4881 8.70011 7.17541 numMergedOcc 0
25 mol 212 unq 1 iso 1 dist 8.13678 8.4881 8.70011 13.3406 8.062 7.17541 numMergedOcc 0
26 mol 235 unq 0 iso 0 dist 8.84872 7.44501 9.11256 10.7196 7.08539 13.6805 numMergedOcc 0
27 mol 235 unq 0 iso 1 dist 8.84872 10.7196 7.08539 7.44501 9.11256 13.6805 numMergedOcc 0
28 mol 241 unq 0 iso 0 dist 8.18588 5.06075 8.40773 13.1806 9.18476 10.5872 numMergedOcc 0
29 mol 241 unq 0 iso 1 dist 8.18588 13.1806 9.18476 5.06075 8.40773 10.5872 numMergedOcc 0
30 mol 253 unq 0 iso 0 dist 9.86979 9.99077 5.89502 11.0003 7.15815 7.05365 numMergedOcc 0
31 mol 253 unq 0 iso 1 dist 9.86979 11.0003 7.15815 9.99077 5.89502 7.05365 numMergedOcc 0
32 mol 277 unq 0 iso 0 dist 6.70123 4.31756 9.77689 11.7666 8.51931 13.7559 numMergedOcc 0
33 mol 277 unq 0 iso 1 dist 6.70123 11.7666 8.51931 4.31756 9.77689 13.7559 numMergedOcc 0
34 mol 292 unq 0 iso 0 dist 8.99442 15.1745 9.6898 4.09108 5.75596 13.4368 numMergedOcc 0
35 mol 292 unq 0 iso 1 dist 8.99442 4.09108 5.75596 15.1745 9.6898 13.4368 numMergedOcc 0
