0 mol 9 unq 0 iso 0 dist 6.89519 6.8848 5.67536 4.07023 6.11048 6.59312 numMergedOcc 0
1 mol 9 unq 1 iso 0 dist 5.24341 6.8848 6.96891 4.07023 8.14998 6.59312 numMergedOcc 0
2 mol 15 unq 0 iso 0 dist 6.82187 8.3794 9.75966 12.4204 8.4014 11.1524 numMergedOcc 0
3 mol 17 unq 0 iso 0 dist 8.58312 7.8304 5.67637 5.56803 8.70792 10.1852 numMergedOcc 0
4 mol 17 unq 1 iso 0 dist 8.58312 5.74567 4.03817 5.56803 8.70792 5.16502 numMergedOcc 0
5 mol 79 unq 0 iso 0 dist 8.0139 5.72627 7.23157 4.15002 5.25027 6.2576 numMergedOcc 0
6 mol 79 unq 1 iso 0 dist 8.0139 5.72627 7.23157 9.36535 4.37025 9.11841 numMergedOcc 0
7 mol 79 unq 2 iso 0 dist 8.0139 7.68741 12.5946 4.15002 5.25027 8.96069 numMergedOcc 0
8 mol 79 unq 3 iso 0 dist 8.0139 7.68741 12.5946 9.36535 4.37025 12.5055 numMergedOcc 0
9 mol 79 unq 4 iso 0 dist 8.0139 9.86085 14.3663 4.15002 5.25027 12.2074 numMergedOcc 0
10 mol 79 unq 5 iso 0 dist 8.0139 9.86085 14.3663 9.36535 4.37025 15.8005 numMergedOcc 0
11 mol 79 unq 6 iso 0 dist 8.0139 9.76351 9.69296 4.15002 5.25027 7.56495 numMergedOcc 0
12 mol 79 unq 7 iso 0 dist 8.0139 9.76351 9.69296 9.36535 4.37025 7.63923 numMergedOcc 0
13 mol 129 unq 0 iso 0 dist 8.00624 9.7113 4.92472 6.61102 7.97548 12.0376 numMergedOcc 0
14 mol 129 unq 1 iso 0 dist 8.00624 9.7113 4.92472 9.0678 9.64164 14.1272 numMergedOcc 0
15 mol 129 unq 2 iso 0 dist 8.42289 9.7113 12.263 6.61102 7.32151 12.0376 numMergedOcc 0
16 mol 147 unq 0 iso 0 dist 9.88662 7.08651 8.57132 10.0388 6.73617 12.4977 numMergedOcc 0
17 mol 147 unq 1 iso 0 dist 9.88662 7.08651 8.57132 9.71714 9.03544 12.6114 numMergedOcc 0
18 mol 147 unq 2 iso 0 dist 9.88662 6.78887 13.3253 10.0388 6.73617 14.9303 numMergedOcc 0
19 mol 147 unq 3 iso 0 dist 9.88662 6.78887 13.3253 9.71714 9.03544 13.7615 numMergedOcc 0
20 mol 168 unq 0 iso 0 dist 8.41715 5.24076 11.7533 3.60864 7.48734 6.12453 numMergedOcc 0
21 mol 168 unq 1 iso 0 dist 7.79893 5.24076 7.32989 3.60864 5.6125 6.12453 numMergedOcc 0
22 mol 206 unq 0 iso 0 dist 8.11407 8.88372 4.62682 3.98316 4.51255 5.17607 numMergedOcc 0
23 mol 206 unq 1 iso 0 dist 8.95375 8.88372 7.67029 3.98316 6.23183 5.17607 numMergedOcc 0
24 mol 241 unq 0 iso 0 dist 7.73213 5.6297 4.90279 9.91137 7.52531 11.207 numMergedOcc 0
25 mol 275 unq 0 iso 0 dist 8.33337 7.01071 4.33371 3.87632 8.81644 5.74353 numMergedOcc 0
26 mol 277 unq 0 iso 0 dist 4.81916 9.35976 7.70529 9.21484 4.9764 10.2401 numMergedOcc 0
27 mol 277 unq 1 iso 0 dist 4.81916 9.35976 7.70529 10.3506 6.36559 12.7666 numMergedOcc 0
