0 mol 4 unq 0 iso 0 dist 8.15534 10.1402 6.85308 5.12159 6.12485 10.9005 numMergedOcc 0
1 mol 4 unq 1 iso 0 dist 8.15534 10.1402 6.85308 10.7952 9.04027 7.5562 numMergedOcc 0
2 mol 4 unq 2 iso 0 dist 7.58769 5.87321 9.76066 5.12159 6.86951 9.0634 numMergedOcc 0
3 mol 21 unq 0 iso 0 dist 5.27589 6.51606 6.9745 10.0167 8.07914 4.43555 numMergedOcc 0
4 mol 29 unq 0 iso 0 dist 9.27422 13.5788 9.37221 8.44709 7.50258 13.6066 numMergedOcc 0
5 mol 69 unq 0 iso 0 dist 7.70037 5.26349 8.58444 5.65257 8.70964 6.23297 numMergedOcc 0
6 mol 69 unq 1 iso 0 dist 7.96207 10.7881 8.58444 13.133 8.70964 6.23297 numMergedOcc 0
7 mol 73 unq 0 iso 0 dist 9.23755 17.4754 8.83749 10.3397 7.58027 12.1867 numMergedOcc 0
8 mol 73 unq 1 iso 0 dist 9.23755 17.4754 8.83749 8.31117 4.34694 11.2608 numMergedOcc 0
9 mol 92 unq 0 iso 0 dist 7.40582 6.74546 8.20203 15.2733 8.15664 14.7779 numMergedOcc 0
10 mol 147 unq 0 iso 0 dist 6.85063 9.0716 9.95567 5.38327 5.32865 5.55557 numMergedOcc 0
11 mol 148 unq 0 iso 0 dist 6.4413 8.18015 9.38554 9.68187 9.18753 8.53692 numMergedOcc 0
12 mol 150 unq 0 iso 0 dist 6.62609 8.14734 9.38048 9.76535 9.15244 8.4233 numMergedOcc 0
13 mol 182 unq 0 iso 0 dist 8.21538 9.47627 7.48402 6.04551 8.85111 9.06782 numMergedOcc 0
14 mol 182 unq 1 iso 0 dist 5.63632 9.38217 7.53236 6.04551 6.38335 7.99073 numMergedOcc 0
15 mol 225 unq 0 iso 0 dist 8.33143 15.8952 9.62052 8.88571 7.65121 9.06809 numMergedOcc 0
16 mol 226 unq 0 iso 0 dist 6.3687 10.2359 7.59794 4.52889 8.74399 8.90041 numMergedOcc 0
17 mol 236 unq 0 iso 0 dist 5.46484 13.2282 9.48237 5.81446 7.74348 16.9403 numMergedOcc 0
18 mol 236 unq 1 iso 0 dist 8.80671 5.43533 9.48237 14.8289 7.74348 16.9403 numMergedOcc 0
19 mol 240 unq 0 iso 0 dist 7.84314 9.95881 8.46784 8.48707 7.19218 4.97595 numMergedOcc 0
20 mol 271 unq 0 iso 0 dist 7.34621 6.98771 9.14523 7.6271 9.00071 9.8595 numMergedOcc 0
21 mol 285 unq 0 iso 0 dist 4.49395 10.5523 8.84177 9.47966 7.872 16.2395 numMergedOcc 0
22 mol 285 unq 1 iso 0 dist 4.49395 10.5523 8.84177 6.49869 6.32984 10.7953 numMergedOcc 0
