0 mol 2 unq 0 iso 0 dist 8.5893 4.00237 5.74846 5.5745 8.75089 6.90295 numMergedOcc 0
1 mol 2 unq 1 iso 0 dist 8.29974 4.00237 4.93584 5.5745 8.39246 6.90295 numMergedOcc 0
2 mol 2 unq 2 iso 0 dist 5.88525 6.42073 5.74846 12.3803 8.75089 6.90295 numMergedOcc 0
3 mol 2 unq 3 iso 0 dist 8.73586 6.42073 4.93584 12.3803 8.39246 6.90295 numMergedOcc 0
4 mol 20 unq 0 iso 0 dist 7.68085 10.7036 8.65986 14.5247 10.5109 6.09002 numMergedOcc 0
5 mol 20 unq 1 iso 0 dist 8.45034 10.7036 9.74724 14.5247 13.0651 6.09002 numMergedOcc 0
6 mol 59 unq 0 iso 0 dist 8.11934 4.82623 6.10199 9.00229 5.43926 8.30217 numMergedOcc 0
7 mol 85 unq 0 iso 0 dist 9.27456 7.41484 7.67463 11.847 6.62562 9.01812 numMergedOcc 0
8 mol 88 unq 0 iso 0 dist 6.64933 4.56066 9.06249 6.35462 4.79268 7.74064 numMergedOcc 0
9 mol 113 unq 0 iso 0 dist 9.43487 7.32784 6.13175 13.2795 10.3188 8.99912 numMergedOcc 0
10 mol 113 unq 1 iso 0 dist 9.97052 11.9142 6.13175 18.9093 10.3188 8.99912 numMergedOcc 0
11 mol 113 unq 2 iso 0 dist 7.3324 8.67805 6.13175 13.7855 10.3188 8.99912 numMergedOcc 0
12 mol 152 unq 0 iso 0 dist 9.06801 12.8334 7.78215 13.1529 8.18329 7.59457 numMergedOcc 0
13 mol 152 unq 1 iso 0 dist 9.06801 12.8334 7.78215 8.07256 5.97115 9.00072 numMergedOcc 0
14 mol 152 unq 2 iso 0 dist 9.06801 12.8334 7.78215 12.6103 4.36394 7.55419 numMergedOcc 0
15 mol 157 unq 0 iso 0 dist 9.9803 9.75069 9.27485 14.2946 6.55112 8.10592 numMergedOcc 0
16 mol 157 unq 1 iso 0 dist 6.09357 6.11737 5.32542 6.1835 3.8758 8.10592 numMergedOcc 0
17 mol 162 unq 0 iso 0 dist 8.99034 10.0292 9.67872 9.97921 5.05715 7.93088 numMergedOcc 0
18 mol 206 unq 0 iso 0 dist 6.38964 10.3421 7.51798 9.78438 6.13816 9.4629 numMergedOcc 0
19 mol 222 unq 0 iso 0 dist 8.33743 9.08651 8.47836 9.55777 8.6493 5.1609 numMergedOcc 0
20 mol 225 unq 0 iso 0 dist 9.28645 6.9328 9.57433 9.86371 4.04791 8.40074 numMergedOcc 0
21 mol 225 unq 1 iso 0 dist 8.9785 3.90226 9.57433 9.13552 4.04791 8.40074 numMergedOcc 0
22 mol 266 unq 0 iso 0 dist 7.01175 12.5076 7.24165 15.8102 11.0673 9.29666 numMergedOcc 0
23 mol 266 unq 1 iso 0 dist 7.50074 14.5235 7.24165 15.082 11.0673 9.29666 numMergedOcc 0
24 mol 274 unq 0 iso 0 dist 9.35835 7.72539 8.87546 8.49076 12.292 8.12739 numMergedOcc 0
25 mol 277 unq 0 iso 0 dist 5.56721 4.20802 6.12608 8.11838 6.2159 5.72327 numMergedOcc 0
26 mol 277 unq 1 iso 0 dist 5.56721 4.20802 6.12608 7.88897 4.39241 5.81301 numMergedOcc 0
27 mol 277 unq 2 iso 0 dist 5.56721 4.20802 6.12608 12.5012 8.47438 9.81201 numMergedOcc 0
28 mol 283 unq 0 iso 0 dist 7.81415 15.5185 9.74797 12.6822 6.79513 9.07995 numMergedOcc 0
