0 mol 11 unq 0 iso 0 dist 9.04534 9.26728 6.83186 9.78754 6.51674 9.81983 15.7037 12.0683 9.89425 9.74251 numMergedOcc 0
1 mol 68 unq 0 iso 0 dist 5.57551 7.27578 7.7485 9.1402 3.56619 9.87699 11.4329 7.18877 8.71074 5.75753 numMergedOcc 0
2 mol 113 unq 0 iso 0 dist 7.08403 3.77247 7.02358 5.37302 3.52111 5.35711 6.12348 3.52445 4.30875 3.84573 numMergedOcc 0
3 mol 168 unq 0 iso 0 dist 8.97414 7.13766 5.86767 8.90876 8.8681 6.12453 9.23064 6.06538 7.0961 12.6805 numMergedOcc 0
4 mol 168 unq 1 iso 0 dist 8.97414 7.13766 5.86767 8.90876 8.8681 6.12453 7.30338 9.99868 8.21227 4.02702 numMergedOcc 0
5 mol 168 unq 2 iso 0 dist 8.97414 7.13766 5.86767 8.90876 8.8681 6.12453 13.0959 10.7133 6.53038 7.61798 numMergedOcc 0
6 mol 169 unq 0 iso 0 dist 7.33643 3.89732 6.96715 5.51388 3.83687 5.41121 6.27683 3.59996 4.11374 3.95773 numMergedOcc 0
7 mol 169 unq 1 iso 0 dist 7.50458 4.24401 5.10589 7.79437 14.1141 9.84538 6.00783 9.60496 8.6961 8.86736 numMergedOcc 0
8 mol 169 unq 2 iso 0 dist 7.78577 3.69097 5.10589 10.1612 6.28646 7.85698 10.7469 3.18152 7.65903 7.40692 numMergedOcc 0
9 mol 169 unq 3 iso 0 dist 7.78577 3.69097 5.10589 8.17917 7.83748 6.35799 10.7469 3.18152 7.65903 9.68109 numMergedOcc 0
10 mol 169 unq 4 iso 0 dist 5.79554 4.24401 4.63336 7.79437 13.1539 9.84538 6.00783 10.5251 8.6961 8.86736 numMergedOcc 0
11 mol 169 unq 5 iso 0 dist 4.22003 4.24401 6.10715 7.79437 11.6489 9.84538 6.00783 8.67112 8.6961 8.86736 numMergedOcc 0
12 mol 186 unq 0 iso 0 dist 7.69952 8.26669 7.25595 14.8919 9.73374 9.31569 17.1511 14.4913 8.92135 10.6999 numMergedOcc 0
13 mol 186 unq 1 iso 0 dist 7.69952 8.26669 7.25595 15.5743 14.2269 8.72743 17.1511 14.4913 8.92135 6.18065 numMergedOcc 0
14 mol 213 unq 0 iso 0 dist 7.49754 7.61073 9.71831 11.6475 6.78109 8.59946 15.5348 14.4808 9.02881 8.99471 numMergedOcc 0
15 mol 285 unq 0 iso 0 dist 6.73396 7.01472 5.88958 13.1934 8.78384 8.79261 8.27917 3.14843 4.27826 6.3633 numMergedOcc 0
16 mol 285 unq 1 iso 0 dist 6.73396 11.0045 7.78121 13.1934 8.78384 9.99125 8.27917 3.14843 5.82074 6.3633 numMergedOcc 0
17 mol 287 unq 0 iso 0 dist 7.84189 9.51119 4.68668 7.76945 5.39801 9.25759 10.251 3.66473 4.93516 5.97664 numMergedOcc 0
18 mol 288 unq 0 iso 0 dist 7.84189 9.51119 4.68668 7.76945 5.39801 9.25759 10.251 3.66473 4.93516 5.97664 numMergedOcc 0
19 mol 289 unq 0 iso 0 dist 7.84189 9.51119 4.68668 7.76945 5.39801 9.25759 10.251 3.66473 4.93516 5.97664 numMergedOcc 0
