0 mol 4 unq 0 iso 0 dist 5.30385 9.77024 10.3461 5.60295 6.42755 14.9489 numMergedOcc 0
1 mol 11 unq 0 iso 0 dist 9.99647 8.36387 16.0433 6.07735 7.5459 14.3805 numMergedOcc 0
2 mol 12 unq 0 iso 0 dist 8.18296 7.99569 5.25297 4.40652 5.76024 7.92714 numMergedOcc 0
3 mol 12 unq 1 iso 0 dist 7.99569 8.18296 5.25297 4.40652 7.92714 5.76024 numMergedOcc 0
4 mol 17 unq 0 iso 0 dist 9.78918 6.80314 7.31113 10.8117 7.25951 7.92012 numMergedOcc 0
5 mol 17 unq 1 iso 0 dist 6.80314 9.78918 7.31113 10.8117 7.92012 7.25951 numMergedOcc 0
6 mol 48 unq 0 iso 0 dist 6.8073 5.60663 9.17835 13.8841 8.29857 13.5279 numMergedOcc 0
7 mol 65 unq 0 iso 0 dist 8.54555 7.0386 5.56801 10.8649 5.94206 10.909 numMergedOcc 0
8 mol 92 unq 0 iso 0 dist 5.74593 8.02376 6.3583 8.27358 5.50508 11.2428 numMergedOcc 0
9 mol 93 unq 0 iso 0 dist 7.13064 7.8962 4.37353 8.41572 8.74378 8.89417 numMergedOcc 0
10 mol 93 unq 1 iso 0 dist 7.8962 7.13064 4.37353 8.41572 8.89417 8.74378 numMergedOcc 0
11 mol 93 unq 2 iso 0 dist 7.8962 7.13064 4.37353 5.74733 9.95255 11.3682 numMergedOcc 0
12 mol 125 unq 0 iso 0 dist 7.00113 9.85979 4.38093 6.22139 6.11502 6.33431 numMergedOcc 0
13 mol 125 unq 1 iso 0 dist 9.85979 7.00113 4.38093 6.22139 6.33431 6.11502 numMergedOcc 0
14 mol 129 unq 0 iso 0 dist 7.32407 6.48695 5.41583 5.9261 9.73158 7.59327 numMergedOcc 0
15 mol 129 unq 1 iso 0 dist 6.48695 7.32407 5.41583 5.9261 7.59327 9.73158 numMergedOcc 0
16 mol 171 unq 0 iso 0 dist 6.4751 5.75085 3.98338 5.72737 7.22518 7.58499 numMergedOcc 0
17 mol 171 unq 1 iso 0 dist 6.4751 5.75085 3.98338 6.4423 5.25109 8.21618 numMergedOcc 0
18 mol 171 unq 2 iso 0 dist 5.75085 6.4751 3.98338 5.72737 7.58499 7.22518 numMergedOcc 0
19 mol 171 unq 3 iso 0 dist 5.75085 6.4751 3.98338 6.4423 8.21618 5.25109 numMergedOcc 0
20 mol 194 unq 0 iso 0 dist 8.09776 5.4455 9.4131 4.44921 6.38324 6.1886 numMergedOcc 0
21 mol 194 unq 1 iso 0 dist 5.4455 8.09776 9.4131 4.44921 6.1886 6.38324 numMergedOcc 0
22 mol 232 unq 0 iso 0 dist 9.25162 6.83927 5.77703 15.3266 9.8664 15.0843 numMergedOcc 0
