0 mol 32 unq 0 iso 0 dist 7.6082 11.1937 9.24687 9.76176 6.76514 8.89775 numMergedOcc 0
1 mol 32 unq 0 iso 1 dist 9.24687 11.1937 7.6082 8.89775 6.76514 9.76176 numMergedOcc 0
2 mol 59 unq 0 iso 0 dist 5.68841 3.60121 7.75769 5.85924 7.37607 9.33131 numMergedOcc 0
3 mol 59 unq 0 iso 1 dist 7.75769 3.60121 5.68841 9.33131 7.37607 5.85924 numMergedOcc 0
4 mol 92 unq 0 iso 0 dist 9.03472 3.58204 9.40274 14.1474 7.36397 15.6773 numMergedOcc 0
5 mol 92 unq 0 iso 1 dist 9.40274 3.58204 9.03472 15.6773 7.36397 14.1474 numMergedOcc 0
6 mol 92 unq 1 iso 0 dist 9.03472 3.58204 9.40274 12.8333 6.58062 14.5544 numMergedOcc 0
7 mol 92 unq 1 iso 1 dist 9.40274 3.58204 9.03472 14.5544 6.58062 12.8333 numMergedOcc 0
8 mol 115 unq 0 iso 0 dist 5.87592 5.11161 8.37388 5.46352 8.77794 10.3995 numMergedOcc 0
9 mol 115 unq 0 iso 1 dist 8.37388 5.11161 5.87592 10.3995 8.77794 5.46352 numMergedOcc 0
10 mol 116 unq 0 iso 0 dist 8.51507 4.61575 8.22285 5.79458 9.88812 9.91115 numMergedOcc 0
11 mol 116 unq 0 iso 1 dist 8.22285 4.61575 8.51507 9.91115 9.88812 5.79458 numMergedOcc 0
12 mol 181 unq 0 iso 0 dist 9.99964 6.3591 6.93144 4.24915 7.88787 4.20499 numMergedOcc 0
13 mol 181 unq 0 iso 1 dist 6.93144 6.3591 9.99964 4.20499 7.88787 4.24915 numMergedOcc 0
14 mol 181 unq 1 iso 0 dist 9.99964 10.1046 7.04782 4.24915 7.88787 6.39513 numMergedOcc 0
15 mol 181 unq 1 iso 1 dist 7.04782 10.1046 9.99964 6.39513 7.88787 4.24915 numMergedOcc 0
16 mol 181 unq 1 iso 0 dist 6.93144 4.53746 7.04782 4.20499 7.88787 6.39513 numMergedOcc 0
17 mol 181 unq 1 iso 1 dist 7.04782 4.53746 6.93144 6.39513 7.88787 4.20499 numMergedOcc 0
18 mol 195 unq 0 iso 0 dist 6.9612 3.98055 4.86882 5.6158 6.52001 4.04021 numMergedOcc 0
19 mol 195 unq 0 iso 1 dist 4.86882 3.98055 6.9612 4.04021 6.52001 5.6158 numMergedOcc 0
20 mol 195 unq 1 iso 0 dist 6.9612 3.98055 4.86882 7.84833 9.70659 8.88132 numMergedOcc 0
21 mol 195 unq 1 iso 1 dist 4.86882 3.98055 6.9612 8.88132 9.70659 7.84833 numMergedOcc 0
22 mol 220 unq 0 iso 0 dist 6.64341 3.70232 7.31315 8.39567 8.45955 6.65038 numMergedOcc 0
23 mol 220 unq 0 iso 1 dist 7.31315 3.70232 6.64341 6.65038 8.45955 8.39567 numMergedOcc 0
24 mol 220 unq 1 iso 0 dist 6.64341 3.70232 7.31315 8.58398 7.64168 9.86325 numMergedOcc 0
25 mol 220 unq 1 iso 1 dist 7.31315 3.70232 6.64341 9.86325 7.64168 8.58398 numMergedOcc 0
26 mol 238 unq 0 iso 0 dist 8.75001 12.1075 6.75599 11.9879 5.72415 5.98329 numMergedOcc 0
27 mol 238 unq 0 iso 1 dist 6.75599 12.1075 8.75001 5.98329 5.72415 11.9879 numMergedOcc 0
28 mol 257 unq 0 iso 0 dist 9.27027 10.2511 7.87058 7.37187 7.48361 7.91645 numMergedOcc 0
29 mol 257 unq 0 iso 1 dist 7.87058 10.2511 9.27027 7.91645 7.48361 7.37187 numMergedOcc 0
30 mol 279 unq 0 iso 0 dist 8.8643 10.7301 5.90456 10.2396 8.50767 6.7711 numMergedOcc 0
31 mol 279 unq 0 iso 1 dist 5.90456 10.7301 8.8643 6.7711 8.50767 10.2396 numMergedOcc 0
32 mol 279 unq 1 iso 0 dist 9.24895 12.7877 8.34154 6.13953 6.10834 6.7711 numMergedOcc 0
33 mol 279 unq 1 iso 1 dist 8.34154 12.7877 9.24895 6.7711 6.10834 6.13953 numMergedOcc 0
