0 mol 61 unq 0 iso 0 dist 6.56878 14.0291 9.94756 10.1514 9.62468 18.7183 numMergedOcc 0
1 mol 61 unq 1 iso 0 dist 6.56395 9.03724 6.85094 10.1514 5.92705 7.15161 numMergedOcc 0
2 mol 73 unq 0 iso 0 dist 9.81722 17.1706 7.84699 5.50724 6.89722 13.4367 numMergedOcc 0
3 mol 73 unq 1 iso 0 dist 9.81722 11.3142 7.53504 5.50724 6.89722 9.64124 numMergedOcc 0
4 mol 73 unq 2 iso 0 dist 8.27446 10.116 8.40844 6.67306 9.68526 5.33851 numMergedOcc 0
5 mol 73 unq 3 iso 0 dist 8.27446 10.116 8.40844 14.8739 7.26679 13.4367 numMergedOcc 0
6 mol 73 unq 4 iso 0 dist 8.27446 10.116 8.40844 8.62642 9.30776 15.7164 numMergedOcc 0
7 mol 73 unq 5 iso 0 dist 8.27446 8.54022 7.02351 6.67306 9.68526 13.6586 numMergedOcc 0
8 mol 73 unq 6 iso 0 dist 8.27446 8.54022 7.02351 14.8739 7.26679 10.3774 numMergedOcc 0
9 mol 73 unq 7 iso 0 dist 8.27446 8.54022 7.02351 8.62642 9.30776 4.15333 numMergedOcc 0
10 mol 73 unq 8 iso 0 dist 8.27446 15.6804 8.66342 6.67306 9.68526 16.8585 numMergedOcc 0
11 mol 73 unq 9 iso 0 dist 8.27446 15.6804 8.66342 14.8739 7.26679 9.64124 numMergedOcc 0
12 mol 73 unq 10 iso 0 dist 8.27446 15.6804 8.66342 8.62642 9.30776 16.0481 numMergedOcc 0
13 mol 73 unq 11 iso 0 dist 9.76332 10.116 6.99156 6.67306 9.72442 5.33851 numMergedOcc 0
14 mol 73 unq 12 iso 0 dist 9.76332 10.116 6.99156 14.9119 9.02288 16.0086 numMergedOcc 0
15 mol 73 unq 13 iso 0 dist 9.76332 15.6804 7.21285 6.67306 9.72442 16.8585 numMergedOcc 0
16 mol 73 unq 14 iso 0 dist 9.76332 15.6804 7.21285 14.9119 9.02288 4.91508 numMergedOcc 0
17 mol 98 unq 0 iso 0 dist 8.97109 6.41525 7.26246 5.10538 7.38759 4.82943 numMergedOcc 0
18 mol 98 unq 1 iso 0 dist 8.97109 7.81617 8.6728 5.10538 7.38759 10.602 numMergedOcc 0
19 mol 102 unq 0 iso 0 dist 8.63253 5.89461 9.61113 8.90571 9.01767 13.9809 numMergedOcc 0
20 mol 102 unq 1 iso 0 dist 8.63253 8.38008 7.73836 8.90571 9.01767 5.09542 numMergedOcc 0
21 mol 102 unq 2 iso 0 dist 5.15752 5.89461 7.59973 5.26061 9.43411 10.3418 numMergedOcc 0
22 mol 102 unq 3 iso 0 dist 5.15752 5.89461 7.59973 8.90571 9.80678 13.9809 numMergedOcc 0
23 mol 181 unq 0 iso 0 dist 6.60482 6.0983 4.35909 8.70038 7.44191 5.32859 numMergedOcc 0
24 mol 222 unq 0 iso 0 dist 8.81385 7.13239 7.10689 6.17038 8.7347 5.01062 numMergedOcc 0
25 mol 235 unq 0 iso 0 dist 9.50104 13.3027 7.52696 7.64039 7.2346 8.38435 numMergedOcc 0
26 mol 238 unq 0 iso 0 dist 8.47921 6.12374 6.32593 11.0676 9.75174 6.53984 numMergedOcc 0
27 mol 249 unq 0 iso 0 dist 8.05967 4.38116 5.66519 7.31764 5.78121 6.47697 numMergedOcc 0
28 mol 249 unq 1 iso 0 dist 8.05967 4.38116 5.66519 12.5964 7.29898 8.68833 numMergedOcc 0
29 mol 249 unq 2 iso 0 dist 9.62613 4.38116 6.50067 12.5964 8.91685 8.68833 numMergedOcc 0
30 mol 249 unq 3 iso 0 dist 8.75137 8.24395 5.66519 10.7823 5.78121 6.47697 numMergedOcc 0
31 mol 249 unq 4 iso 0 dist 8.75137 8.24395 5.66519 4.24754 7.29898 8.68833 numMergedOcc 0
32 mol 249 unq 5 iso 0 dist 7.82699 8.24395 6.50067 4.24754 8.91685 8.68833 numMergedOcc 0
33 mol 277 unq 0 iso 0 dist 5.73065 5.57184 9.42812 8.05749 8.57532 10.7202 numMergedOcc 0
34 mol 277 unq 1 iso 0 dist 5.73065 5.57184 9.42812 13.2922 9.02914 17.0927 numMergedOcc 0
35 mol 277 unq 2 iso 0 dist 5.73065 5.57184 9.42812 11.9195 6.90434 16.2915 numMergedOcc 0
