0 mol 71 unq 0 iso 0 dist 8.39608 3.91691 8.92529 6.82169 6.59302 4.96361 10.3685 7.50921 7.78799 4.36469 numMergedOcc 0
1 mol 71 unq 1 iso 0 dist 8.39608 3.91691 8.92529 13.8437 9.93626 11.7369 10.3685 7.50921 7.78799 7.62008 numMergedOcc 0
2 mol 71 unq 2 iso 0 dist 7.28815 10.1018 8.92529 10.5616 6.59302 4.96361 9.85206 7.50921 7.78799 4.36469 numMergedOcc 0
3 mol 71 unq 3 iso 0 dist 7.28815 10.1018 8.92529 6.46657 9.93626 11.7369 9.85206 7.50921 7.78799 7.62008 numMergedOcc 0
4 mol 171 unq 0 iso 0 dist 6.20851 5.93953 6.19457 9.38497 7.13078 3.96523 9.12839 9.67711 10.9652 11.7688 numMergedOcc 0
5 mol 186 unq 0 iso 0 dist 5.31333 4.43567 9.2254 9.58526 5.80433 11.9365 9.03587 5.27578 12.8633 8.96928 numMergedOcc 0
6 mol 186 unq 1 iso 0 dist 5.31333 4.43567 9.2254 11.0885 6.8285 13.7178 9.03587 5.27578 12.8633 6.66771 numMergedOcc 0
7 mol 187 unq 0 iso 0 dist 5.82577 10.7172 5.58167 9.55801 6.56642 6.47437 5.93957 5.7938 8.06583 4.36904 numMergedOcc 0
8 mol 187 unq 1 iso 0 dist 5.82577 10.7172 5.58167 5.94354 7.9625 10.7843 5.93957 5.7938 8.06583 9.20573 numMergedOcc 0
9 mol 187 unq 2 iso 0 dist 5.82577 4.75665 8.0501 9.55801 6.56642 7.95559 5.93957 5.7938 3.94358 4.36904 numMergedOcc 0
10 mol 187 unq 3 iso 0 dist 5.82577 4.75665 8.0501 5.94354 7.9625 9.27977 5.93957 5.7938 3.94358 9.20573 numMergedOcc 0
11 mol 204 unq 0 iso 0 dist 8.40718 12.4189 6.20044 7.96412 9.01377 13.2711 12.5259 5.81438 7.35194 9.00714 numMergedOcc 0
12 mol 204 unq 1 iso 0 dist 8.40718 12.8445 8.41232 7.96412 9.01377 10.5475 12.5259 5.81438 5.87202 9.00714 numMergedOcc 0
13 mol 220 unq 0 iso 0 dist 8.55805 4.74145 6.39087 10.8658 9.13234 7.56892 5.06821 8.63649 4.4227 6.38339 numMergedOcc 0
14 mol 226 unq 0 iso 0 dist 7.54614 12.983 8.74399 4.91346 7.45381 12.3027 10.2945 8.31266 5.27153 11.6435 numMergedOcc 0
15 mol 266 unq 0 iso 0 dist 9.33791 8.55958 8.8646 6.11645 5.45375 8.73313 3.79641 8.62843 9.70494 7.54682 numMergedOcc 0
16 mol 266 unq 1 iso 0 dist 9.33791 8.55958 8.8646 5.7716 9.9145 13.3737 3.79641 8.62843 9.70494 5.72821 numMergedOcc 0
17 mol 273 unq 0 iso 0 dist 9.80002 5.87385 5.78262 14.2814 6.59786 8.67797 10.6534 8.66133 5.53908 8.0478 numMergedOcc 0
18 mol 273 unq 1 iso 0 dist 9.80002 5.87385 5.78262 14.2814 6.59786 8.67797 15.8245 6.95569 12.7125 10.0013 numMergedOcc 0
19 mol 273 unq 2 iso 0 dist 9.80002 5.87385 5.78262 17.5382 7.96519 13.2599 10.6534 8.66133 5.53908 14.4172 numMergedOcc 0
20 mol 273 unq 3 iso 0 dist 9.80002 5.87385 5.78262 17.5382 7.96519 13.2599 15.8245 6.95569 12.7125 4.42663 numMergedOcc 0
21 mol 273 unq 4 iso 0 dist 9.80002 10.5975 7.6489 14.2814 6.59786 9.47855 10.6534 8.66133 12.7274 8.0478 numMergedOcc 0
22 mol 273 unq 5 iso 0 dist 9.80002 10.5975 7.6489 14.2814 6.59786 9.47855 15.8245 6.95569 10.8576 10.0013 numMergedOcc 0
23 mol 273 unq 6 iso 0 dist 9.80002 10.5975 7.6489 17.5382 7.96519 10.9195 10.6534 8.66133 12.7274 14.4172 numMergedOcc 0
24 mol 273 unq 7 iso 0 dist 9.80002 10.5975 7.6489 17.5382 7.96519 10.9195 15.8245 6.95569 10.8576 4.42663 numMergedOcc 0
25 mol 273 unq 8 iso 0 dist 6.73794 3.92089 5.78262 9.11005 6.59786 8.67797 3.80794 8.66133 5.53908 8.0478 numMergedOcc 0
26 mol 273 unq 9 iso 0 dist 6.73794 3.92089 5.78262 9.11005 6.59786 8.67797 13.255 6.95569 12.7125 10.0013 numMergedOcc 0
27 mol 273 unq 10 iso 0 dist 6.73794 3.92089 5.78262 13.7838 7.96519 13.2599 3.80794 8.66133 5.53908 14.4172 numMergedOcc 0
28 mol 273 unq 11 iso 0 dist 6.73794 3.92089 5.78262 13.7838 7.96519 13.2599 13.255 6.95569 12.7125 4.42663 numMergedOcc 0
29 mol 273 unq 12 iso 0 dist 6.73794 12.0094 7.6489 9.11005 6.59786 9.47855 3.80794 8.66133 12.7274 8.0478 numMergedOcc 0
30 mol 273 unq 13 iso 0 dist 6.73794 12.0094 7.6489 9.11005 6.59786 9.47855 13.255 6.95569 10.8576 10.0013 numMergedOcc 0
31 mol 273 unq 14 iso 0 dist 6.73794 12.0094 7.6489 13.7838 7.96519 10.9195 3.80794 8.66133 12.7274 14.4172 numMergedOcc 0
32 mol 273 unq 15 iso 0 dist 6.73794 12.0094 7.6489 13.7838 7.96519 10.9195 13.255 6.95569 10.8576 4.42663 numMergedOcc 0
33 mol 285 unq 0 iso 0 dist 5.76796 11.2606 7.872 5.49583 7.61398 9.51445 9.11313 5.49829 3.05975 8.8752 numMergedOcc 0
34 mol 285 unq 1 iso 0 dist 5.76796 11.2606 7.872 5.49583 7.61398 9.51445 6.01574 6.24134 11.5704 10.6055 numMergedOcc 0
35 mol 285 unq 2 iso 0 dist 5.76796 8.7778 6.32984 5.49583 7.61398 11.5961 9.11313 5.49829 5.76392 8.8752 numMergedOcc 0
36 mol 285 unq 3 iso 0 dist 5.76796 8.7778 6.32984 5.49583 7.61398 11.5961 6.01574 6.24134 4.4744 10.6055 numMergedOcc 0
