0 mol 24 unq 0 iso 0 dist 8.13365 7.63824 9.76111 4.09817 10.2862 9.58192 numMergedOcc 0
1 mol 51 unq 0 iso 0 dist 8.99612 6.64146 4.63184 4.85938 12.7972 9.11764 numMergedOcc 0
2 mol 62 unq 0 iso 0 dist 9.27092 6.58981 6.8858 5.81231 13.1382 8.93807 numMergedOcc 0
3 mol 62 unq 1 iso 0 dist 6.56664 9.1926 9.17877 6.38075 9.97079 7.16844 numMergedOcc 0
4 mol 62 unq 2 iso 0 dist 9.58156 9.1926 13.7909 6.38075 15.2735 7.16844 numMergedOcc 0
5 mol 76 unq 0 iso 0 dist 9.32453 8.63792 3.69293 9.51274 10.2456 9.57759 numMergedOcc 0
6 mol 95 unq 0 iso 0 dist 8.27456 9.98215 17.0418 3.94084 10.3995 8.72957 numMergedOcc 0
7 mol 95 unq 1 iso 0 dist 8.13273 4.81841 4.73066 3.84897 8.27883 4.3439 numMergedOcc 0
8 mol 95 unq 2 iso 0 dist 8.13273 4.81841 4.73066 5.78182 5.75428 6.05855 numMergedOcc 0
9 mol 95 unq 3 iso 0 dist 8.29852 4.81841 4.20834 3.84897 7.7152 4.3439 numMergedOcc 0
10 mol 95 unq 4 iso 0 dist 8.29852 4.81841 4.20834 5.78182 10.0848 6.05855 numMergedOcc 0
11 mol 110 unq 0 iso 0 dist 7.2461 7.59747 6.79448 4.10689 8.49678 9.25023 numMergedOcc 0
12 mol 110 unq 1 iso 0 dist 9.26333 7.59747 3.80114 4.10689 10.8328 9.25023 numMergedOcc 0
13 mol 113 unq 0 iso 0 dist 9.57352 9.44 6.54263 15.8274 14.9043 8.67025 numMergedOcc 0
14 mol 113 unq 1 iso 0 dist 9.57352 8.47634 3.92558 3.66763 11.6298 9.60127 numMergedOcc 0
15 mol 116 unq 0 iso 0 dist 7.55822 6.98134 5.49724 8.3164 8.28795 9.87354 numMergedOcc 0
16 mol 120 unq 0 iso 0 dist 8.14799 8.44206 3.35803 9.64212 9.85307 9.98772 numMergedOcc 0
17 mol 158 unq 0 iso 0 dist 9.03632 6.51748 6.60451 9.50276 10.1006 6.77583 numMergedOcc 0
18 mol 186 unq 0 iso 0 dist 8.8508 7.00382 4.63377 5.74741 11.573 9.4366 numMergedOcc 0
19 mol 186 unq 1 iso 0 dist 7.09426 8.78251 4.04122 12.6481 7.2793 9.34653 numMergedOcc 0
20 mol 252 unq 0 iso 0 dist 7.58175 8.88629 8.75116 6.96456 11.7529 7.62991 numMergedOcc 0
21 mol 257 unq 0 iso 0 dist 8.95261 9.79593 10.9989 3.84196 8.83833 7.80473 numMergedOcc 0
