0 mol 26 unq 0 iso 0 dist 8.98417 8.67162 8.35396 7.46244 6.56527 4.27162 numMergedOcc 0
1 mol 48 unq 0 iso 0 dist 6.8073 11.4497 5.78969 13.8841 8.29857 5.68596 numMergedOcc 0
2 mol 48 unq 1 iso 0 dist 6.42242 11.208 5.7898 13.5334 8.19993 5.69576 numMergedOcc 0
3 mol 114 unq 0 iso 0 dist 4.86767 5.27337 5.32751 6.72133 8.42878 11.5261 numMergedOcc 0
4 mol 116 unq 0 iso 0 dist 8.03113 9.09763 9.28045 13.3662 8.38606 9.60499 numMergedOcc 0
5 mol 116 unq 1 iso 0 dist 9.2638 16.4013 9.28045 10.4136 8.38606 9.60499 numMergedOcc 0
6 mol 171 unq 0 iso 0 dist 6.4751 13.1082 6.73995 5.72737 7.22518 12.8052 numMergedOcc 0
7 mol 171 unq 1 iso 0 dist 6.4751 13.1082 6.73995 6.4423 5.25109 9.23265 numMergedOcc 0
8 mol 171 unq 2 iso 0 dist 6.4751 13.0534 8.619 5.72737 7.22518 14.7924 numMergedOcc 0
9 mol 171 unq 3 iso 0 dist 6.4751 13.0534 8.619 6.4423 5.25109 7.86006 numMergedOcc 0
10 mol 181 unq 0 iso 0 dist 6.03403 5.63854 8.84599 5.80215 5.94379 5.96277 numMergedOcc 0
11 mol 232 unq 0 iso 0 dist 9.25162 9.84054 6.02641 15.3266 9.8664 6.25229 numMergedOcc 0
12 mol 247 unq 0 iso 0 dist 6.29945 11.0856 7.21548 5.44215 8.45756 9.41711 numMergedOcc 0
13 mol 266 unq 0 iso 0 dist 6.77259 5.62596 9.60449 9.63118 7.00243 14.63 numMergedOcc 0
14 mol 280 unq 0 iso 0 dist 9.38952 8.99273 8.83569 5.87081 6.73712 4.71431 numMergedOcc 0
15 mol 280 unq 1 iso 0 dist 9.38952 8.99273 8.83569 10.1012 9.35704 14.8215 numMergedOcc 0
16 mol 280 unq 2 iso 0 dist 7.42529 5.84126 8.83569 7.98547 6.73712 4.71431 numMergedOcc 0
17 mol 280 unq 3 iso 0 dist 7.42529 5.84126 8.83569 15.5627 9.35704 14.8215 numMergedOcc 0
