0 mol 9 unq 0 iso 0 dist 7.25179 13.7 8.57077 6.62605 6.85412 8.27962 10.8001 5.60154 8.47421 9.29529 numMergedOcc 0
1 mol 9 unq 1 iso 0 dist 7.25179 13.7 8.57077 4.75933 6.33889 11.4878 10.8001 5.60154 8.47421 7.2199 numMergedOcc 0
2 mol 9 unq 2 iso 0 dist 8.72522 16.5569 8.57077 11.0121 6.85412 8.27962 10.7994 5.60154 8.47421 9.29529 numMergedOcc 0
3 mol 9 unq 3 iso 0 dist 8.72522 16.5569 8.57077 6.35665 6.33889 11.4878 10.7994 5.60154 8.47421 7.2199 numMergedOcc 0
4 mol 26 unq 0 iso 0 dist 7.34549 4.76147 8.34347 7.23551 6.73162 7.23546 9.08976 11.887 9.16962 15.0652 numMergedOcc 0
5 mol 26 unq 1 iso 0 dist 8.09068 6.30129 8.34347 4.03252 6.73162 7.23546 14.8032 11.887 9.16962 15.0652 numMergedOcc 0
6 mol 26 unq 2 iso 0 dist 9.72289 5.93227 8.34347 8.34836 6.73162 7.23546 13.0219 11.887 9.16962 15.0652 numMergedOcc 0
7 mol 115 unq 0 iso 0 dist 5.11612 10.3475 9.33865 5.39389 7.76729 10.7942 11.0433 6.09023 9.66954 12.4065 numMergedOcc 0
8 mol 115 unq 1 iso 0 dist 5.11612 10.3475 9.33865 5.39389 7.76729 10.7942 9.95565 10.2377 7.64585 6.40036 numMergedOcc 0
9 mol 115 unq 2 iso 0 dist 5.11612 6.86762 5.83991 5.39389 7.76729 10.9739 11.0433 6.09023 8.66155 12.4065 numMergedOcc 0
10 mol 115 unq 3 iso 0 dist 5.22628 10.0419 9.33865 9.16391 9.66954 6.09023 10.2245 10.7942 7.76729 12.4065 numMergedOcc 0
11 mol 115 unq 4 iso 0 dist 5.22628 10.0419 9.33865 5.26498 7.64585 10.2377 10.2245 10.7942 7.76729 6.40036 numMergedOcc 0
12 mol 115 unq 5 iso 0 dist 5.22628 6.8104 6.11741 9.16391 9.66954 4.61908 12.7277 10.8292 6.99777 9.9411 numMergedOcc 0
13 mol 115 unq 6 iso 0 dist 5.22628 6.8104 6.11741 9.16391 9.66954 4.61908 11.1013 6.12943 9.14376 11.764 numMergedOcc 0
14 mol 115 unq 7 iso 0 dist 5.22628 6.8104 6.11741 5.26498 7.64585 10.8939 12.7277 10.8292 6.99777 17.3282 numMergedOcc 0
15 mol 115 unq 8 iso 0 dist 5.22628 6.8104 6.11741 5.26498 7.64585 10.8939 11.1013 6.12943 9.14376 12.1188 numMergedOcc 0
16 mol 127 unq 0 iso 0 dist 8.09965 11.3174 9.30299 9.46933 8.59981 14.085 10.4013 4.77464 9.81878 6.3244 numMergedOcc 0
17 mol 127 unq 1 iso 0 dist 8.09965 11.3174 9.30299 6.50291 7.34519 13.1312 10.4013 4.77464 9.81878 11.7518 numMergedOcc 0
18 mol 175 unq 0 iso 0 dist 7.94593 13.2723 9.0018 11.0605 9.31887 11.0415 13.2601 8.22779 9.8589 4.79852 numMergedOcc 0
19 mol 175 unq 1 iso 0 dist 7.94593 8.63795 7.652 11.0605 9.31887 5.0384 13.2601 8.22779 7.24908 4.79852 numMergedOcc 0
20 mol 181 unq 0 iso 0 dist 9.50454 11.755 7.63312 10.9336 6.93764 4.80231 8.22583 9.60512 7.98142 10.7841 numMergedOcc 0
21 mol 181 unq 1 iso 0 dist 9.50454 11.755 7.63312 10.9336 6.93764 4.80231 12.8564 13.3389 7.37327 11.1129 numMergedOcc 0
22 mol 181 unq 2 iso 0 dist 7.15963 6.73556 5.98885 9.09192 6.94688 5.86342 10.4914 5.4601 7.20046 10.5561 numMergedOcc 0
23 mol 181 unq 3 iso 0 dist 7.15963 6.73556 5.98885 9.09192 6.94688 5.86342 12.7342 10.0524 7.13543 11.7007 numMergedOcc 0
24 mol 181 unq 4 iso 0 dist 7.15963 6.73556 5.98885 12.1848 6.71012 9.14057 10.4914 5.4601 7.20046 9.94131 numMergedOcc 0
25 mol 181 unq 5 iso 0 dist 7.15963 6.73556 5.98885 12.1848 6.71012 9.14057 12.7342 10.0524 7.13543 12.8673 numMergedOcc 0
26 mol 181 unq 6 iso 0 dist 7.15963 5.49666 9.15386 9.09192 6.94688 6.80228 7.82604 8.25067 9.6668 8.20656 numMergedOcc 0
27 mol 181 unq 7 iso 0 dist 7.15963 5.49666 9.15386 12.1848 6.71012 11.6919 7.82604 8.25067 9.6668 9.40622 numMergedOcc 0
28 mol 181 unq 8 iso 0 dist 6.43406 10.9813 7.81386 4.56814 4.93785 6.7991 15.0054 9.53462 7.98142 12.2455 numMergedOcc 0
29 mol 181 unq 9 iso 0 dist 6.43406 10.9813 7.81386 4.56814 4.93785 6.7991 14.1437 11.1462 7.37327 11.691 numMergedOcc 0
30 mol 181 unq 10 iso 0 dist 8.80581 10.209 7.63312 5.98221 6.93764 4.80231 16.0943 9.60512 7.98142 10.7841 numMergedOcc 0
31 mol 181 unq 11 iso 0 dist 8.80581 10.209 7.63312 5.98221 6.93764 4.80231 17.06 13.3389 7.37327 11.1129 numMergedOcc 0
32 mol 224 unq 0 iso 0 dist 9.61379 9.57016 8.95269 4.53973 7.06793 9.36098 11.9527 7.98696 6.87664 8.89778 numMergedOcc 0
33 mol 224 unq 1 iso 0 dist 9.61379 9.57016 8.95269 5.98813 6.67585 5.29877 11.9527 7.98696 6.87664 9.47554 numMergedOcc 0
34 mol 235 unq 0 iso 0 dist 8.84872 4.28841 5.4638 13.4086 9.58736 9.66021 11.4738 4.65302 8.21247 11.9287 numMergedOcc 0
35 mol 238 unq 0 iso 0 dist 8.39522 4.88998 6.57393 10.4124 6.91569 10.9761 6.59305 6.20606 5.38637 11.9092 numMergedOcc 0
36 mol 248 unq 0 iso 0 dist 9.5107 11.8955 7.69895 7.39322 6.07192 6.48757 17.8606 10.1857 8.50864 13.4404 numMergedOcc 0
37 mol 282 unq 0 iso 0 dist 7.12228 4.36798 6.33524 7.00729 7.32347 6.3384 10.7897 7.36881 8.8673 13.4504 numMergedOcc 0
