0 mol 55 unq 0 iso 0 dist 9.30367 7.43154 11.6572 11.3663 19.2947 9.63353 numMergedOcc 0
1 mol 55 unq 1 iso 0 dist 6.67079 7.66471 5.41761 8.02914 9.07741 8.9899 numMergedOcc 0
2 mol 55 unq 2 iso 0 dist 6.67079 7.66471 5.41761 10.9066 8.0388 8.45058 numMergedOcc 0
3 mol 55 unq 3 iso 0 dist 6.67079 7.66471 5.41761 6.53022 9.7883 7.73542 numMergedOcc 0
4 mol 55 unq 4 iso 0 dist 7.14636 7.66471 9.8912 8.02914 12.5408 8.9899 numMergedOcc 0
5 mol 55 unq 5 iso 0 dist 7.14636 7.66471 9.8912 10.9066 12.7048 8.45058 numMergedOcc 0
6 mol 55 unq 6 iso 0 dist 7.14636 7.66471 9.8912 6.53022 12.8789 7.73542 numMergedOcc 0
7 mol 55 unq 7 iso 0 dist 8.07849 8.05787 7.039 13.1058 14.1823 8.9899 numMergedOcc 0
8 mol 55 unq 8 iso 0 dist 8.07849 8.05787 7.039 14.3366 12.1744 8.45058 numMergedOcc 0
9 mol 55 unq 9 iso 0 dist 8.07849 8.05787 7.039 9.31655 12.8528 7.73542 numMergedOcc 0
10 mol 60 unq 0 iso 0 dist 9.54864 8.4928 10.5228 10.4126 15.7245 6.46718 numMergedOcc 0
11 mol 63 unq 0 iso 0 dist 9.35912 9.16658 10.9414 5.04771 9.21258 4.92457 numMergedOcc 0
12 mol 63 unq 1 iso 0 dist 9.35912 8.94047 10.57 5.04771 9.21258 8.18666 numMergedOcc 0
13 mol 73 unq 0 iso 0 dist 9.27331 8.91206 6.28525 7.85784 10.1296 8.59337 numMergedOcc 0
14 mol 73 unq 1 iso 0 dist 9.27331 8.91206 6.28525 14.3054 11.0617 7.66942 numMergedOcc 0
15 mol 73 unq 2 iso 0 dist 6.328 8.67513 5.9876 12.9922 13.6889 8.59337 numMergedOcc 0
16 mol 73 unq 3 iso 0 dist 6.328 8.67513 5.9876 12.2368 10.1289 7.66942 numMergedOcc 0
17 mol 76 unq 0 iso 0 dist 6.98862 4.66377 5.00699 5.90148 10.7355 6.97741 numMergedOcc 0
18 mol 79 unq 0 iso 0 dist 7.41952 6.07578 3.51719 10.2068 10.0307 8.51933 numMergedOcc 0
19 mol 105 unq 0 iso 0 dist 8.80388 5.74652 9.68577 5.31338 14.0364 9.09664 numMergedOcc 0
20 mol 105 unq 1 iso 0 dist 7.28156 5.74652 7.14906 5.31338 12.1449 9.09664 numMergedOcc 0
21 mol 143 unq 0 iso 0 dist 7.64085 6.93136 6.07527 9.60132 13.6401 8.56866 numMergedOcc 0
22 mol 143 unq 1 iso 0 dist 7.64085 6.93136 6.07527 11.9534 9.11815 5.66207 numMergedOcc 0
23 mol 152 unq 0 iso 0 dist 7.71277 9.19078 10.4193 11.5151 15.8717 7.34557 numMergedOcc 0
24 mol 163 unq 0 iso 0 dist 9.85967 9.29539 10.8136 16.5782 15.6175 7.69757 numMergedOcc 0
25 mol 173 unq 0 iso 0 dist 5.97008 4.0037 8.32122 8.29493 9.26806 9.02222 numMergedOcc 0
26 mol 186 unq 0 iso 0 dist 9.08767 5.67811 8.32573 9.25561 15.0964 7.88501 numMergedOcc 0
27 mol 186 unq 1 iso 0 dist 9.08767 5.67811 8.32573 7.75953 11.8348 9.09585 numMergedOcc 0
28 mol 281 unq 0 iso 0 dist 6.7897 7.86146 9.96217 10.8186 12.4337 8.2659 numMergedOcc 0
29 mol 282 unq 0 iso 0 dist 8.61456 6.91282 6.85098 12.5442 13.4825 9.18236 numMergedOcc 0
30 mol 282 unq 1 iso 0 dist 8.41041 5.51953 6.85098 7.00145 13.4825 9.18236 numMergedOcc 0
