0 mol 24 unq 0 iso 0 dist 5.54419 4.93188 4.33963 8.23075 6.7846 4.21283 12.3067 7.36323 9.24958 10.551 numMergedOcc 0
1 mol 24 unq 1 iso 0 dist 5.54419 4.93188 4.33963 4.7841 8.03955 4.97191 12.3067 7.36323 9.24958 14.1707 numMergedOcc 0
2 mol 43 unq 0 iso 0 dist 8.80331 9.93832 9.06158 7.39848 9.86609 6.59887 8.13395 6.20293 8.60739 11.4251 numMergedOcc 0
3 mol 58 unq 0 iso 0 dist 6.64012 7.27383 6.37648 6.79356 5.87468 6.21346 6.47414 9.4099 12.5444 12.2384 numMergedOcc 0
4 mol 73 unq 0 iso 0 dist 8.70481 8.85586 14.8866 7.37171 15.1432 12.6176 14.9342 9.96396 16.8706 21.1182 numMergedOcc 0
5 mol 73 unq 1 iso 0 dist 8.70481 8.85586 14.8866 7.37171 15.1432 12.6176 13.3558 6.19304 18.0011 19.3924 numMergedOcc 0
6 mol 73 unq 2 iso 0 dist 8.70481 7.11 8.05119 7.37171 15.1432 14.2305 14.9342 9.96396 12.4407 21.1182 numMergedOcc 0
7 mol 73 unq 3 iso 0 dist 8.70481 7.11 8.05119 7.37171 15.1432 14.2305 13.3558 6.19304 12.0613 19.3924 numMergedOcc 0
8 mol 85 unq 0 iso 0 dist 7.95579 8.00777 5.08358 9.01812 8.37717 4.06365 4.26409 6.19965 7.1589 9.90583 numMergedOcc 0
9 mol 85 unq 1 iso 0 dist 7.95579 8.00777 5.08358 9.01812 8.37717 4.06365 10.7229 7.66905 11.2808 15.0494 numMergedOcc 0
10 mol 85 unq 2 iso 0 dist 6.19965 7.33422 7.91778 8.04242 8.18948 9.09756 5.42586 7.97049 12.3486 11.5901 numMergedOcc 0
11 mol 85 unq 3 iso 0 dist 7.66905 7.33422 10.121 8.04242 14.113 9.09756 5.42586 7.47541 12.3486 11.5901 numMergedOcc 0
12 mol 85 unq 4 iso 0 dist 7.66905 7.33422 10.121 8.04242 14.113 9.09756 10.1164 5.73196 14.9249 17.4114 numMergedOcc 0
13 mol 131 unq 0 iso 0 dist 6.85062 9.29384 9.32969 8.80895 11.6692 9.6795 10.7062 8.40312 11.4206 17.775 numMergedOcc 0
14 mol 131 unq 1 iso 0 dist 6.85062 9.29384 9.32969 8.80895 11.6692 9.6795 6.63273 7.12972 6.92648 12.9064 numMergedOcc 0
15 mol 152 unq 0 iso 0 dist 5.87555 8.35555 5.59336 6.79114 4.68615 4.78989 5.42328 6.70283 10.4911 10.338 numMergedOcc 0
16 mol 152 unq 1 iso 0 dist 5.87555 8.35555 5.59336 6.79114 4.68615 4.78989 5.54906 8.67331 13.0858 10.3706 numMergedOcc 0
17 mol 152 unq 2 iso 0 dist 5.87555 8.35555 5.59336 7.59457 4.73288 9.43672 5.42328 6.70283 10.4911 9.00072 numMergedOcc 0
18 mol 152 unq 3 iso 0 dist 5.87555 8.35555 5.59336 7.59457 4.73288 9.43672 5.54906 8.67331 13.0858 7.55419 numMergedOcc 0
19 mol 152 unq 4 iso 0 dist 8.87437 8.35555 10.9728 6.79114 9.35878 4.78989 5.42328 7.16148 10.4911 10.338 numMergedOcc 0
20 mol 152 unq 5 iso 0 dist 8.87437 8.35555 10.9728 6.79114 9.35878 4.78989 5.54906 8.05741 13.0858 10.3706 numMergedOcc 0
21 mol 152 unq 6 iso 0 dist 8.87437 8.35555 10.9728 7.59457 4.70284 9.43672 5.42328 7.16148 10.4911 9.00072 numMergedOcc 0
22 mol 152 unq 7 iso 0 dist 8.87437 8.35555 10.9728 7.59457 4.70284 9.43672 5.54906 8.05741 13.0858 7.55419 numMergedOcc 0
23 mol 152 unq 8 iso 0 dist 8.56324 9.77552 9.35627 7.55934 9.73449 6.69469 7.65448 6.70283 8.28642 11.2397 numMergedOcc 0
24 mol 152 unq 9 iso 0 dist 8.56324 9.77552 9.35627 7.55934 9.73449 6.69469 10.6875 7.16148 13.1536 15.1951 numMergedOcc 0
25 mol 205 unq 0 iso 0 dist 7.26832 5.60393 5.28092 7.13783 13.3822 12.0319 7.38516 6.03031 8.44861 13.3708 numMergedOcc 0
26 mol 205 unq 1 iso 0 dist 7.26832 5.60393 5.28092 7.13783 13.3822 12.0319 13.8543 7.80463 11.3521 20.4298 numMergedOcc 0
27 mol 206 unq 0 iso 0 dist 9.774 8.70977 9.9412 6.23183 7.83734 11.5047 5.63422 7.7366 12.3357 4.51255 numMergedOcc 0
28 mol 248 unq 0 iso 0 dist 7.69895 6.17052 5.99459 7.79063 6.19721 4.91893 5.55137 7.21521 9.77666 9.64778 numMergedOcc 0
29 mol 248 unq 1 iso 0 dist 7.69895 6.17052 5.99459 7.79063 6.19721 4.91893 10.8081 8.2965 13.0539 11.1716 numMergedOcc 0
30 mol 248 unq 2 iso 0 dist 7.21521 9.77666 5.99459 9.64778 6.19721 4.91893 5.55137 7.69895 6.17052 7.79063 numMergedOcc 0
31 mol 248 unq 3 iso 0 dist 7.21521 9.77666 5.99459 9.64778 6.19721 4.91893 5.86196 8.2965 13.0539 11.1716 numMergedOcc 0
32 mol 253 unq 0 iso 0 dist 6.73034 9.66465 6.89124 8.94786 8.57513 3.15936 8.02948 8.31064 13.1441 13.723 numMergedOcc 0
33 mol 253 unq 1 iso 0 dist 6.73034 9.66465 6.89124 9.1927 6.0222 5.26612 8.02948 8.31064 13.1441 9.19385 numMergedOcc 0
34 mol 253 unq 2 iso 0 dist 6.73034 9.66465 6.89124 9.60694 6.93212 13.8016 8.02948 8.31064 13.1441 7.14243 numMergedOcc 0
35 mol 253 unq 3 iso 0 dist 6.73034 9.66465 6.89124 9.27311 10.2118 16.4545 8.02948 8.31064 13.1441 5.77511 numMergedOcc 0
36 mol 261 unq 0 iso 0 dist 8.45658 8.60026 6.04016 8.24356 11.4108 11.1232 7.00201 9.14619 5.26434 12.3855 numMergedOcc 0
