0 mol 28 unq 0 iso 0 dist 8.40467 9.6867 6.67638 10.8781 8.95552 5.38074 numMergedOcc 0
1 mol 28 unq 1 iso 0 dist 8.40467 5.13138 6.29954 10.8781 8.95552 9.07545 numMergedOcc 0
2 mol 28 unq 2 iso 0 dist 7.24073 6.62196 5.6954 8.55448 9.98522 12.5414 numMergedOcc 0
3 mol 28 unq 3 iso 0 dist 7.24073 7.61351 5.18775 8.55448 9.98522 6.77538 numMergedOcc 0
4 mol 37 unq 0 iso 0 dist 6.84257 9.70008 6.10776 5.8086 9.49441 13.1803 numMergedOcc 0
5 mol 73 unq 0 iso 0 dist 7.32265 8.0534 6.88106 15.5344 8.49022 13.8674 numMergedOcc 0
6 mol 130 unq 0 iso 0 dist 6.21554 7.67321 6.00932 6.1956 8.28884 5.38314 numMergedOcc 0
7 mol 133 unq 0 iso 0 dist 9.82274 6.39075 10.1254 13.5772 7.46812 12.1458 numMergedOcc 0
8 mol 141 unq 0 iso 0 dist 8.5614 5.77628 11.3907 11.2477 6.27859 11.074 numMergedOcc 0
9 mol 141 unq 1 iso 0 dist 8.5614 5.77628 11.3907 13.1825 6.28535 15.8163 numMergedOcc 0
10 mol 152 unq 0 iso 0 dist 9.54774 7.27943 13.3124 7.8634 9.08475 12.7928 numMergedOcc 0
11 mol 183 unq 0 iso 0 dist 9.84649 6.86657 5.9727 12.0052 8.55287 12.209 numMergedOcc 0
12 mol 186 unq 0 iso 0 dist 7.6409 9.03496 4.89182 5.44077 9.61384 12.7829 numMergedOcc 0
13 mol 193 unq 0 iso 0 dist 8.71993 7.46207 9.78229 6.6036 9.53066 8.76185 numMergedOcc 0
