0 mol 24 unq 0 iso 0 dist 7.40392 8.56483 5.59311 8.92687 8.4051 12.8389 15.0861 15.5315 19.5098 7.29868 numMergedOcc 0
1 mol 24 unq 1 iso 0 dist 7.40392 8.56483 5.59311 8.92687 8.4051 12.8389 11.6497 14.6259 18.8774 8.60554 numMergedOcc 0
2 mol 24 unq 2 iso 0 dist 7.40392 8.56483 5.59311 5.12527 8.75662 11.6684 11.6497 14.6259 18.8774 9.44691 numMergedOcc 0
3 mol 26 unq 0 iso 0 dist 8.90473 4.9737 5.81765 6.09666 7.36856 6.93197 9.77906 7.96502 7.23703 6.46104 numMergedOcc 0
4 mol 62 unq 0 iso 0 dist 8.27156 9.51503 10.0059 5.40878 4.74544 11.4928 12.0244 8.62608 18.0795 7.56205 numMergedOcc 0
5 mol 92 unq 0 iso 0 dist 9.96446 6.15011 8.70803 15.5614 8.18107 15.4529 6.70686 5.04493 8.87994 9.8859 numMergedOcc 0
6 mol 92 unq 1 iso 0 dist 9.96446 6.15011 8.70803 8.51558 5.9465 6.77241 6.70686 5.04493 8.87994 6.97962 numMergedOcc 0
7 mol 92 unq 2 iso 0 dist 9.96446 6.15011 8.70803 8.51558 5.9465 6.77241 13.1422 9.35561 7.52639 9.95342 numMergedOcc 0
8 mol 92 unq 3 iso 0 dist 6.70686 6.15011 8.87994 15.5614 9.8859 15.4529 9.96446 5.04493 8.70803 8.18107 numMergedOcc 0
9 mol 92 unq 4 iso 0 dist 6.70686 6.15011 8.87994 8.51558 6.97962 6.77241 9.96446 5.04493 8.70803 5.9465 numMergedOcc 0
10 mol 92 unq 5 iso 0 dist 6.70686 6.15011 8.87994 8.51558 6.97962 6.77241 13.1422 12.7769 7.52639 9.95342 numMergedOcc 0
11 mol 100 unq 0 iso 0 dist 9.61812 9.58313 4.86592 7.76066 7.80975 5.75014 14.7281 10.8586 7.96533 7.10378 numMergedOcc 0
12 mol 134 unq 0 iso 0 dist 4.68975 7.85849 4.60632 6.64576 5.83771 6.40575 4.9155 5.79898 5.71679 7.80532 numMergedOcc 0
13 mol 134 unq 1 iso 0 dist 4.9155 7.85849 5.71679 6.64576 7.80532 6.40575 4.68975 5.79898 4.60632 5.83771 numMergedOcc 0
14 mol 134 unq 2 iso 0 dist 9.42271 6.08299 5.71679 5.87436 7.80532 6.40575 9.15658 5.79898 4.60632 5.83771 numMergedOcc 0
15 mol 181 unq 0 iso 0 dist 6.09874 9.01017 6.06566 5.06341 6.22122 7.32087 9.75336 6.01247 4.43096 6.2479 numMergedOcc 0
16 mol 181 unq 1 iso 0 dist 6.09874 9.01017 6.06566 5.06341 6.22122 7.32087 12.9131 12.6324 12.2164 7.99195 numMergedOcc 0
17 mol 235 unq 0 iso 0 dist 5.60236 8.08581 5.5163 5.86896 6.36341 6.94789 11.2471 8.31875 7.77516 6.21292 numMergedOcc 0
18 mol 235 unq 1 iso 0 dist 5.60236 8.08581 5.5163 5.86896 6.36341 6.94789 13.8175 10.5547 11.7254 9.21736 numMergedOcc 0
19 mol 235 unq 2 iso 0 dist 9.03917 5.98104 5.5163 4.88651 6.36341 6.94789 6.56775 8.31875 7.77516 6.21292 numMergedOcc 0
20 mol 235 unq 3 iso 0 dist 9.03917 5.98104 5.5163 4.88651 6.36341 6.94789 10.8773 10.5547 11.7254 9.21736 numMergedOcc 0
21 mol 235 unq 4 iso 0 dist 6.56775 5.98104 7.77516 4.88651 6.21292 6.94789 9.03917 8.31875 5.5163 6.36341 numMergedOcc 0
22 mol 235 unq 5 iso 0 dist 6.56775 5.98104 7.77516 4.88651 6.21292 6.94789 10.8773 4.53064 11.7254 9.21736 numMergedOcc 0
23 mol 235 unq 6 iso 0 dist 6.56775 5.98104 7.77516 6.99274 6.95126 10.7602 14.469 9.89669 14.7526 9.55668 numMergedOcc 0
24 mol 278 unq 0 iso 0 dist 9.91518 6.9592 14.3412 11.8916 8.00673 18.3508 14.371 8.29447 20.4536 6.62841 numMergedOcc 0
25 mol 284 unq 0 iso 0 dist 9.98268 6.53769 15.3251 4.58432 9.33437 10.6861 6.83147 5.87439 10.6664 7.8343 numMergedOcc 0
26 mol 284 unq 1 iso 0 dist 6.83147 6.53769 10.6664 4.58432 7.8343 10.6861 9.98268 5.87439 15.3251 9.33437 numMergedOcc 0
