0 mol 26 unq 0 iso 0 dist 8.07937 13.3615 7.89667 10.6139 5.3315 8.31381 numMergedOcc 0
1 mol 26 unq 1 iso 0 dist 6.42206 3.63999 7.89667 7.34549 5.3315 8.31381 numMergedOcc 0
2 mol 26 unq 2 iso 0 dist 9.66602 13.5789 7.89667 9.72289 5.3315 8.31381 numMergedOcc 0
3 mol 78 unq 0 iso 0 dist 8.61468 13.4907 8.48827 9.45835 7.17843 7.91148 numMergedOcc 0
4 mol 78 unq 1 iso 0 dist 8.61468 10.4533 7.14048 9.45835 7.17843 6.59794 numMergedOcc 0
5 mol 78 unq 2 iso 0 dist 6.27186 13.4907 8.03895 9.45835 4.4651 7.91148 numMergedOcc 0
6 mol 78 unq 3 iso 0 dist 6.27186 10.4533 5.68873 9.45835 4.4651 6.59794 numMergedOcc 0
7 mol 85 unq 0 iso 0 dist 9.66549 11.9486 9.86038 12.9998 5.8457 8.04242 numMergedOcc 0
8 mol 88 unq 0 iso 0 dist 5.59846 9.17488 9.40699 14.7301 12.0948 7.74064 numMergedOcc 0
9 mol 113 unq 0 iso 0 dist 8.28452 3.7042 7.08403 8.29529 14.0364 7.02367 numMergedOcc 0
10 mol 113 unq 1 iso 0 dist 8.44004 12.5507 7.08403 18.9382 14.0364 7.02367 numMergedOcc 0
11 mol 133 unq 0 iso 0 dist 9.86691 5.27905 4.82356 9.05674 4.84607 5.78814 numMergedOcc 0
12 mol 133 unq 1 iso 0 dist 5.59311 4.88335 8.22722 14.1499 17.2785 9.72387 numMergedOcc 0
13 mol 133 unq 2 iso 0 dist 5.7232 4.88335 8.52036 14.1499 16.4238 9.72387 numMergedOcc 0
14 mol 141 unq 0 iso 0 dist 8.0302 3.48408 6.41183 12.2525 5.91683 9.3273 numMergedOcc 0
15 mol 141 unq 1 iso 0 dist 6.65051 5.71838 6.41183 11.4589 5.91683 9.3273 numMergedOcc 0
16 mol 141 unq 2 iso 0 dist 9.41519 10.616 6.41183 14.5087 5.91683 9.3273 numMergedOcc 0
17 mol 147 unq 0 iso 0 dist 6.28769 7.56825 8.76449 10.4679 6.91778 6.73617 numMergedOcc 0
18 mol 147 unq 1 iso 0 dist 6.28769 5.56838 8.36182 10.4679 6.91778 9.03544 numMergedOcc 0
19 mol 183 unq 0 iso 0 dist 8.53483 13.7852 7.16035 17.9523 10.0008 9.96536 numMergedOcc 0
20 mol 183 unq 1 iso 0 dist 8.58404 11.9399 7.16035 17.0649 10.0008 9.96536 numMergedOcc 0
21 mol 183 unq 2 iso 0 dist 8.1126 11.9399 9.61725 17.0649 9.95614 9.96536 numMergedOcc 0
22 mol 183 unq 3 iso 0 dist 8.50695 7.39071 9.01531 15.2229 9.81623 9.96536 numMergedOcc 0
23 mol 186 unq 0 iso 0 dist 7.45384 12.0957 9.14525 8.16369 4.94882 5.90765 numMergedOcc 0
24 mol 196 unq 0 iso 0 dist 5.76319 5.97525 6.10505 7.84536 4.57882 4.67869 numMergedOcc 0
25 mol 196 unq 1 iso 0 dist 5.30132 4.22321 6.10505 7.07723 4.57882 4.67869 numMergedOcc 0
26 mol 196 unq 2 iso 0 dist 8.36119 10.866 6.10505 10.6609 4.57882 4.67869 numMergedOcc 0
27 mol 253 unq 0 iso 0 dist 7.02076 9.06758 8.71119 12.6977 11.8779 9.19385 numMergedOcc 0
28 mol 253 unq 1 iso 0 dist 7.02076 9.06758 8.71119 17.1511 15.4152 9.1927 numMergedOcc 0
29 mol 259 unq 0 iso 0 dist 6.83706 3.94409 6.69951 10.0986 8.70769 8.25897 numMergedOcc 0
30 mol 265 unq 0 iso 0 dist 8.09021 3.5393 5.8898 6.78702 5.75478 5.7944 numMergedOcc 0
31 mol 265 unq 1 iso 0 dist 6.98451 3.99477 5.8898 8.59825 5.75478 5.7944 numMergedOcc 0
32 mol 270 unq 0 iso 0 dist 6.55866 5.81979 7.97614 7.05331 5.00269 8.65354 numMergedOcc 0
33 mol 294 unq 0 iso 0 dist 8.88961 11.7154 7.48987 12.0075 5.57606 7.56669 numMergedOcc 0
