0 mol 15 unq 0 iso 0 dist 8.0637 4.27439 7.42909 7.57076 8.00576 5.82801 7.38118 5.70754 5.68079 9.93049 numMergedOcc 0
1 mol 28 unq 0 iso 0 dist 5.9948 8.24316 8.34712 6.76158 11.7233 11.1346 4.3475 8.76224 7.7871 8.53424 numMergedOcc 0
2 mol 28 unq 1 iso 0 dist 5.9948 8.24316 8.34712 7.423 13.0183 10.8275 4.3475 8.76224 7.7871 7.08766 numMergedOcc 0
3 mol 28 unq 2 iso 0 dist 5.9948 8.24316 8.34712 5.89257 10.9699 7.90018 4.3475 8.76224 7.7871 4.82199 numMergedOcc 0
4 mol 48 unq 0 iso 0 dist 7.55854 7.49678 9.90363 9.29102 3.60325 10.1404 11.6027 14.9479 8.10222 16.6329 numMergedOcc 0
5 mol 76 unq 0 iso 0 dist 9.0101 8.08674 4.00834 8.26805 9.68005 11.6853 6.27527 6.46582 5.91098 7.66068 numMergedOcc 0
6 mol 76 unq 1 iso 0 dist 9.0101 8.08674 4.00834 9.68577 14.6547 15.0489 6.27527 6.46582 5.91098 9.5043 numMergedOcc 0
7 mol 76 unq 2 iso 0 dist 9.0101 8.33694 9.6911 8.26805 9.68005 4.94673 6.27527 6.46582 4.86523 7.66068 numMergedOcc 0
8 mol 76 unq 3 iso 0 dist 9.0101 8.33694 9.6911 9.68577 14.6547 5.78236 6.27527 6.46582 4.86523 9.5043 numMergedOcc 0
9 mol 88 unq 0 iso 0 dist 9.79535 9.75856 5.53481 9.57352 14.0189 14.3183 7.19267 9.40699 5.6516 14.0875 numMergedOcc 0
10 mol 88 unq 1 iso 0 dist 7.33521 9.75856 14.384 9.57352 6.41397 14.3183 7.19267 11.6378 5.6516 14.0875 numMergedOcc 0
11 mol 90 unq 0 iso 0 dist 8.91055 8.60438 4.59148 7.30934 7.8463 4.77556 4.3421 10.6901 8.63446 5.24346 numMergedOcc 0
12 mol 98 unq 0 iso 0 dist 6.31509 9.74889 6.99582 5.91023 4.48773 7.22521 5.90092 9.68556 9.45257 6.5816 numMergedOcc 0
13 mol 98 unq 1 iso 0 dist 6.14782 9.74889 10.1149 5.91023 3.8493 7.22521 5.90092 9.23905 9.45257 6.5816 numMergedOcc 0
14 mol 98 unq 2 iso 0 dist 8.49806 9.74889 4.34199 5.91023 3.78499 7.22521 5.90092 8.73928 9.45257 6.5816 numMergedOcc 0
15 mol 114 unq 0 iso 0 dist 5.99873 8.25015 12.5061 8.18193 6.83136 15.571 6.06647 8.66766 8.53631 13.4064 numMergedOcc 0
16 mol 260 unq 0 iso 0 dist 8.79012 5.16772 13.9264 7.13397 3.48905 11.9315 4.38276 9.46576 6.90472 8.62655 numMergedOcc 0
17 mol 260 unq 1 iso 0 dist 8.79012 5.16772 13.9264 5.33278 8.84611 8.79837 4.38276 9.46576 6.90472 9.01781 numMergedOcc 0
18 mol 266 unq 0 iso 0 dist 9.477 9.51286 5.54798 6.9943 3.87565 5.79323 4.58167 7.93375 6.48382 6.96692 numMergedOcc 0
19 mol 266 unq 1 iso 0 dist 9.477 9.51286 5.54798 7.36685 9.25882 7.52317 4.58167 7.93375 6.48382 8.25286 numMergedOcc 0
20 mol 266 unq 2 iso 0 dist 9.477 9.51286 5.54798 9.03099 12.1357 9.52953 4.58167 7.93375 6.48382 9.9965 numMergedOcc 0
