0 mol 20 unq 0 iso 0 dist 7.55864 7.10314 8.65986 10.7143 10.5109 6.09002 numMergedOcc 0
1 mol 20 unq 1 iso 0 dist 9.33568 7.10314 9.74724 10.7143 13.0651 6.09002 numMergedOcc 0
2 mol 69 unq 0 iso 0 dist 6.80561 8.29483 9.60811 11.1375 6.14227 9.83836 numMergedOcc 0
3 mol 81 unq 0 iso 0 dist 8.6092 9.48254 5.70283 14.7609 8.57859 5.51927 numMergedOcc 0
4 mol 81 unq 1 iso 0 dist 8.82476 12.2335 7.16741 15.0997 11.453 5.51927 numMergedOcc 0
5 mol 81 unq 2 iso 0 dist 9.78923 12.939 7.16741 18.1216 11.453 5.51927 numMergedOcc 0
6 mol 81 unq 3 iso 0 dist 6.38981 9.48254 7.16741 14.7609 11.453 5.51927 numMergedOcc 0
7 mol 85 unq 0 iso 0 dist 7.54915 14.8283 7.67463 12.3148 6.62562 9.01812 numMergedOcc 0
8 mol 111 unq 0 iso 0 dist 7.22098 4.88926 7.24101 8.42147 6.3561 5.98809 numMergedOcc 0
9 mol 124 unq 0 iso 0 dist 7.46623 3.75669 9.0745 9.91381 10.872 8.57739 numMergedOcc 0
10 mol 152 unq 0 iso 0 dist 9.61301 6.37913 9.981 12.7397 14.4437 7.59457 numMergedOcc 0
11 mol 152 unq 1 iso 0 dist 9.61301 6.37913 9.981 13.0082 17.8807 9.00072 numMergedOcc 0
12 mol 152 unq 2 iso 0 dist 9.61301 6.37913 9.981 9.74498 13.3193 7.55419 numMergedOcc 0
13 mol 206 unq 0 iso 0 dist 5.71819 4.22218 7.51798 10.1373 6.13816 9.4629 numMergedOcc 0
14 mol 206 unq 1 iso 0 dist 8.48679 3.57449 7.51798 8.31638 6.13816 9.4629 numMergedOcc 0
15 mol 206 unq 2 iso 0 dist 9.86924 13.0094 7.51798 10.0788 6.13816 9.4629 numMergedOcc 0
16 mol 206 unq 3 iso 0 dist 7.44186 13.6373 7.51798 9.72979 6.13816 9.4629 numMergedOcc 0
17 mol 257 unq 0 iso 0 dist 9.75866 6.57478 8.86142 14.1093 8.14464 9.6834 numMergedOcc 0
18 mol 283 unq 0 iso 0 dist 5.7378 7.27864 9.74797 9.53225 6.79513 9.07995 numMergedOcc 0
19 mol 283 unq 1 iso 0 dist 7.15632 16.7441 9.74797 12.5381 6.79513 9.07995 numMergedOcc 0
20 mol 285 unq 0 iso 0 dist 8.45077 3.97296 7.8605 8.71213 6.40962 6.71946 numMergedOcc 0
