0 mol 7 unq 0 iso 0 dist 7.38748 6.22892 5.0893 5.13744 8.77133 6.36911 numMergedOcc 0
1 mol 8 unq 0 iso 0 dist 8.68949 8.89145 13.2274 6.88402 8.70858 14.849 numMergedOcc 0
2 mol 8 unq 1 iso 0 dist 8.68949 6.92865 8.33226 6.88402 8.70858 8.99126 numMergedOcc 0
3 mol 42 unq 0 iso 0 dist 5.52834 8.52254 4.38082 6.79455 6.51963 7.41857 numMergedOcc 0
4 mol 64 unq 0 iso 0 dist 5.66803 5.54343 5.9853 10.0913 7.77991 13.3487 numMergedOcc 0
5 mol 64 unq 1 iso 0 dist 5.66803 5.54343 5.9853 5.68492 5.1488 8.68586 numMergedOcc 0
6 mol 64 unq 2 iso 0 dist 8.85416 9.99634 6.43864 8.21081 7.77991 9.80142 numMergedOcc 0
7 mol 64 unq 3 iso 0 dist 8.85416 9.99634 6.43864 11.6323 5.1488 9.54144 numMergedOcc 0
8 mol 73 unq 0 iso 0 dist 8.90896 5.79954 4.78435 13.1044 6.96647 8.70133 numMergedOcc 0
9 mol 87 unq 0 iso 0 dist 9.90256 5.26938 5.30415 7.62644 9.53368 7.51358 numMergedOcc 0
10 mol 87 unq 1 iso 0 dist 9.90256 5.26938 5.30415 10.8096 6.54532 8.93296 numMergedOcc 0
11 mol 87 unq 2 iso 0 dist 9.90256 8.91602 11.2095 7.62644 9.53368 8.32298 numMergedOcc 0
12 mol 87 unq 3 iso 0 dist 9.90256 8.91602 11.2095 10.8096 6.54532 14.2495 numMergedOcc 0
13 mol 87 unq 4 iso 0 dist 7.57471 6.8014 5.30415 5.5768 9.53368 7.51358 numMergedOcc 0
14 mol 87 unq 5 iso 0 dist 7.57471 6.8014 5.30415 4.56692 6.54532 8.93296 numMergedOcc 0
15 mol 114 unq 0 iso 0 dist 6.54778 5.97879 5.0333 5.84883 6.06039 6.73814 numMergedOcc 0
16 mol 114 unq 1 iso 0 dist 6.54778 5.97879 5.0333 10.9953 9.36502 11.8516 numMergedOcc 0
17 mol 133 unq 0 iso 0 dist 8.76088 8.96061 8.99025 5.31306 8.03691 11.1745 numMergedOcc 0
18 mol 159 unq 0 iso 0 dist 6.86212 8.55431 5.10423 3.90437 9.23757 10.6557 numMergedOcc 0
19 mol 162 unq 0 iso 0 dist 6.59407 9.42819 9.00663 8.08223 8.8048 16.1368 numMergedOcc 0
20 mol 181 unq 0 iso 0 dist 9.40718 9.63295 5.32364 10.602 9.23089 6.93764 numMergedOcc 0
21 mol 186 unq 0 iso 0 dist 6.72718 6.99623 5.25279 9.77203 7.46024 11.2582 numMergedOcc 0
22 mol 230 unq 0 iso 0 dist 9.24729 8.33847 12.2372 10.2514 7.08409 11.8967 numMergedOcc 0
23 mol 258 unq 0 iso 0 dist 5.53369 8.55181 5.49492 4.92263 9.31129 12.1978 numMergedOcc 0
24 mol 258 unq 1 iso 0 dist 8.57274 8.55181 5.80854 4.92263 9.77741 12.1978 numMergedOcc 0
