0 mol 48 unq 0 iso 0 dist 6.04551 7.49794 13.0811 13.7393 19.598 7.1829 numMergedOcc 0
1 mol 48 unq 1 iso 0 dist 7.38928 7.99434 9.85208 11.0398 14.4137 7.11491 numMergedOcc 0
2 mol 48 unq 2 iso 0 dist 8.36915 8.26877 10.4965 14.2257 17.2031 7.11491 numMergedOcc 0
3 mol 48 unq 3 iso 0 dist 6.01454 8.26877 13.688 14.2257 20.0061 7.11491 numMergedOcc 0
4 mol 48 unq 4 iso 0 dist 6.31161 7.49794 5.91316 13.7393 12.7064 7.1829 numMergedOcc 0
5 mol 76 unq 0 iso 0 dist 6.98862 8.08224 5.03002 13.3539 13.8626 8.99536 numMergedOcc 0
6 mol 76 unq 1 iso 0 dist 6.98862 8.08224 5.03002 10.5949 10.1408 5.94317 numMergedOcc 0
7 mol 79 unq 0 iso 0 dist 7.41952 6.65972 8.14479 8.69896 13.0659 6.86517 numMergedOcc 0
8 mol 79 unq 1 iso 0 dist 7.41952 6.65972 8.14479 10.3307 15.5038 8.33791 numMergedOcc 0
9 mol 79 unq 2 iso 0 dist 7.41952 4.2253 9.07516 10.3307 15.5038 7.38548 numMergedOcc 0
10 mol 92 unq 0 iso 0 dist 7.12199 4.91714 4.69684 8.27358 11.4989 6.89071 numMergedOcc 0
11 mol 92 unq 1 iso 0 dist 7.90837 4.91714 9.94373 8.27358 14.5245 6.89071 numMergedOcc 0
12 mol 143 unq 0 iso 0 dist 7.64085 9.99012 5.64264 11.6598 11.6873 7.2932 numMergedOcc 0
13 mol 175 unq 0 iso 0 dist 8.6609 8.06007 12.9272 10.3139 12.4201 4.51777 numMergedOcc 0
14 mol 175 unq 1 iso 0 dist 8.6609 8.06007 12.9272 7.04147 10.7245 4.9606 numMergedOcc 0
15 mol 175 unq 2 iso 0 dist 6.21546 8.06007 7.97895 10.3139 9.27911 4.51777 numMergedOcc 0
16 mol 175 unq 3 iso 0 dist 6.21546 8.06007 7.97895 7.04147 8.57607 4.9606 numMergedOcc 0
17 mol 175 unq 4 iso 0 dist 6.03184 8.06007 9.57126 10.3139 13.2069 4.51777 numMergedOcc 0
18 mol 175 unq 5 iso 0 dist 6.03184 8.06007 9.57126 7.04147 11.4305 4.9606 numMergedOcc 0
19 mol 182 unq 0 iso 0 dist 9.07183 6.55146 3.67039 12.0639 12.9845 9.98182 numMergedOcc 0
20 mol 186 unq 0 iso 0 dist 8.39345 4.79423 6.35206 9.50013 10.2291 9.31569 numMergedOcc 0
21 mol 186 unq 1 iso 0 dist 8.39345 4.79423 6.35206 8.59979 14.9503 8.72743 numMergedOcc 0
22 mol 249 unq 0 iso 0 dist 7.58833 6.62413 7.19269 11.2425 15.2001 8.76518 numMergedOcc 0
23 mol 249 unq 1 iso 0 dist 9.04715 6.62413 4.77145 11.2425 12.8292 8.76518 numMergedOcc 0
24 mol 280 unq 0 iso 0 dist 7.02503 7.00616 3.76721 5.87081 10.705 9.47429 numMergedOcc 0
25 mol 280 unq 1 iso 0 dist 9.18164 9.19653 3.76721 11.8683 10.705 9.47429 numMergedOcc 0
