0 mol 4 unq 0 iso 0 dist 5.39008 6.10734 5.12621 6.21799 5.69713 5.58487 numMergedOcc 0
1 mol 13 unq 0 iso 0 dist 6.02651 9.65051 10.4833 9.78622 9.41423 7.98679 numMergedOcc 0
2 mol 34 unq 0 iso 0 dist 6.30436 9.13116 4.81608 14.262 12.5629 9.63403 numMergedOcc 0
3 mol 68 unq 0 iso 0 dist 5.48997 8.87151 9.58376 4.28426 6.4776 6.40693 numMergedOcc 0
4 mol 76 unq 0 iso 0 dist 9.225 4.73362 4.98309 7.18485 14.621 9.75201 numMergedOcc 0
5 mol 76 unq 1 iso 0 dist 9.225 9.61367 10.7367 8.88275 14.3653 6.66954 numMergedOcc 0
6 mol 76 unq 2 iso 0 dist 5.37449 7.3795 7.75939 12.7451 15.2405 9.75201 numMergedOcc 0
7 mol 76 unq 3 iso 0 dist 9.52666 7.3795 4.98309 12.7451 14.621 9.75201 numMergedOcc 0
8 mol 96 unq 0 iso 0 dist 8.71026 9.87414 12.8509 4.96607 10.3036 7.3964 numMergedOcc 0
9 mol 98 unq 0 iso 0 dist 7.88143 6.04768 12.9271 10.8678 15.3406 6.62972 numMergedOcc 0
10 mol 98 unq 1 iso 0 dist 6.62952 6.04768 12.2431 10.8678 16.4455 6.62972 numMergedOcc 0
11 mol 98 unq 2 iso 0 dist 4.3521 9.40173 12.2431 13.5865 16.4455 6.62972 numMergedOcc 0
12 mol 141 unq 0 iso 0 dist 8.5614 7.38183 9.5453 10.8036 13.8138 6.73983 numMergedOcc 0
13 mol 141 unq 1 iso 0 dist 8.5614 7.38183 9.5453 12.1363 12.4454 8.6387 numMergedOcc 0
14 mol 156 unq 0 iso 0 dist 5.50879 8.32841 5.6621 14.911 13.0787 7.46845 numMergedOcc 0
15 mol 156 unq 1 iso 0 dist 6.69157 6.56065 5.6621 11.1159 13.0787 7.46845 numMergedOcc 0
16 mol 162 unq 0 iso 0 dist 9.68937 8.24791 5.81787 4.45888 10.8821 7.58035 numMergedOcc 0
17 mol 162 unq 1 iso 0 dist 9.68937 8.24791 5.81787 7.98745 4.49707 8.21989 numMergedOcc 0
18 mol 186 unq 0 iso 0 dist 7.6409 8.09667 4.93748 5.37893 7.95201 5.45675 numMergedOcc 0
19 mol 193 unq 0 iso 0 dist 8.71993 6.28889 9.08423 11.6364 14.9807 8.67745 numMergedOcc 0
20 mol 193 unq 1 iso 0 dist 8.71993 6.28889 9.08423 8.4769 11.7787 9.41624 numMergedOcc 0
21 mol 210 unq 0 iso 0 dist 8.94889 8.78652 4.36112 5.20757 5.6524 5.57779 numMergedOcc 0
22 mol 210 unq 1 iso 0 dist 8.94889 9.01437 10.7545 5.20757 5.6524 7.05649 numMergedOcc 0
23 mol 226 unq 0 iso 0 dist 8.24741 6.82883 4.66376 7.21532 10.4619 6.26945 numMergedOcc 0
24 mol 226 unq 1 iso 0 dist 8.24741 6.95495 13.3747 7.21532 10.4619 6.37744 numMergedOcc 0
25 mol 226 unq 2 iso 0 dist 5.07958 8.22518 4.66376 12.0613 10.4619 6.26945 numMergedOcc 0
26 mol 226 unq 3 iso 0 dist 6.19519 6.02803 4.66376 10.6196 10.4619 6.26945 numMergedOcc 0
27 mol 279 unq 0 iso 0 dist 7.14122 7.61501 6.2981 5.15042 11.2616 8.55729 numMergedOcc 0
