0 mol 10 unq 0 iso 0 dist 9.1686 11.9528 9.06457 11.6447 5.04413 7.14537 numMergedOcc 0
1 mol 10 unq 1 iso 0 dist 8.99402 4.87654 9.06457 9.77054 5.04413 7.14537 numMergedOcc 0
2 mol 10 unq 2 iso 0 dist 7.3489 13.9362 9.06457 7.74463 5.04413 7.14537 numMergedOcc 0
3 mol 29 unq 0 iso 0 dist 7.71924 5.3571 7.71617 8.26334 4.98274 5.09702 numMergedOcc 0
4 mol 64 unq 0 iso 0 dist 9.3473 10.6331 6.46589 12.8127 5.70508 8.92221 numMergedOcc 0
5 mol 64 unq 1 iso 0 dist 8.14932 8.87081 6.46589 13.5894 5.70508 8.92221 numMergedOcc 0
6 mol 66 unq 0 iso 0 dist 8.95789 9.62896 9.00438 17.0067 12.9761 9.6145 numMergedOcc 0
7 mol 66 unq 1 iso 0 dist 8.95789 9.62896 9.00438 15.4321 9.94694 8.32859 numMergedOcc 0
8 mol 76 unq 0 iso 0 dist 7.02854 5.69691 8.5069 6.14248 8.66335 9.08825 numMergedOcc 0
9 mol 79 unq 0 iso 0 dist 7.41952 8.12985 8.0318 9.90428 6.2804 8.51259 numMergedOcc 0
10 mol 127 unq 0 iso 0 dist 8.48435 7.11961 9.17001 16.5555 13.5387 9.97028 numMergedOcc 0
11 mol 130 unq 0 iso 0 dist 7.9663 7.12852 7.06547 9.67398 9.69908 7.5573 numMergedOcc 0
12 mol 130 unq 1 iso 0 dist 7.9663 7.12852 7.06547 12.5102 10.1463 9.58633 numMergedOcc 0
13 mol 130 unq 2 iso 0 dist 6.54338 3.79867 7.06547 10.5464 9.69908 7.5573 numMergedOcc 0
14 mol 130 unq 3 iso 0 dist 6.54338 3.79867 7.06547 12.617 10.1463 9.58633 numMergedOcc 0
15 mol 130 unq 4 iso 0 dist 8.50054 9.23498 9.88678 14.6805 10.0666 7.5573 numMergedOcc 0
16 mol 130 unq 5 iso 0 dist 8.50054 9.23498 9.88678 14.6415 8.33905 9.58633 numMergedOcc 0
17 mol 130 unq 6 iso 0 dist 7.47653 9.23498 7.06547 14.6805 9.69908 7.5573 numMergedOcc 0
18 mol 130 unq 7 iso 0 dist 7.47653 9.23498 7.06547 14.6415 10.1463 9.58633 numMergedOcc 0
19 mol 143 unq 0 iso 0 dist 6.68364 5.88056 5.44814 9.84746 12.4579 9.29944 numMergedOcc 0
20 mol 157 unq 0 iso 0 dist 9.668 5.332 9.35772 10.9016 11.0863 8.40821 numMergedOcc 0
21 mol 162 unq 0 iso 0 dist 8.954 8.39434 9.95076 6.51243 5.09521 9.43904 numMergedOcc 0
22 mol 162 unq 1 iso 0 dist 8.954 4.92282 7.76112 6.51243 5.09521 7.01095 numMergedOcc 0
23 mol 178 unq 0 iso 0 dist 8.14441 11.8474 6.95432 13.8517 6.12844 7.86352 numMergedOcc 0
24 mol 206 unq 0 iso 0 dist 8.63033 4.61338 5.83021 11.7464 5.84459 9.95026 numMergedOcc 0
25 mol 206 unq 1 iso 0 dist 8.63033 4.61338 5.83021 10.3085 4.25315 9.09594 numMergedOcc 0
26 mol 206 unq 2 iso 0 dist 8.02214 4.61338 9.18711 11.7464 7.76853 9.95026 numMergedOcc 0
27 mol 206 unq 3 iso 0 dist 8.02214 4.61338 9.18711 10.3085 4.89614 9.09594 numMergedOcc 0
28 mol 214 unq 0 iso 0 dist 7.25293 4.47554 5.79617 10.1284 7.78712 9.43017 numMergedOcc 0
29 mol 235 unq 0 iso 0 dist 7.99218 7.41522 4.36956 10.2111 5.39025 6.03081 numMergedOcc 0
30 mol 235 unq 1 iso 0 dist 7.99218 7.41522 4.36956 11.57 4.3433 5.1874 numMergedOcc 0
31 mol 235 unq 2 iso 0 dist 7.99218 6.179 8.43799 10.2111 5.39025 7.41433 numMergedOcc 0
32 mol 238 unq 0 iso 0 dist 5.57184 5.36582 8.28643 9.67281 12.4194 4.66186 numMergedOcc 0
33 mol 273 unq 0 iso 0 dist 8.26333 10.4999 8.31704 11.2987 8.83577 9.02537 numMergedOcc 0
34 mol 277 unq 0 iso 0 dist 6.23539 5.38166 8.18813 11.2458 13.3706 7.16209 numMergedOcc 0
35 mol 277 unq 1 iso 0 dist 6.23539 5.38166 8.18813 9.4543 12.1739 4.62936 numMergedOcc 0
