0 mol 26 unq 0 iso 0 dist 9.7522 4.21886 9.80897 15.0931 8.34347 12.8257 11.7823 6.73162 11.1917 7.23546 numMergedOcc 0
1 mol 26 unq 1 iso 0 dist 9.7522 8.25891 8.37225 15.0931 8.34347 8.70636 11.7823 6.73162 6.0365 7.23546 numMergedOcc 0
2 mol 43 unq 0 iso 0 dist 8.38387 4.99287 8.03754 11.0096 8.80331 14.0204 6.35048 9.83618 10.1053 10.4442 numMergedOcc 0
3 mol 43 unq 1 iso 0 dist 8.38387 4.99287 8.03754 11.8286 6.20293 13.1056 6.35048 9.83618 10.1053 9.49077 numMergedOcc 0
4 mol 64 unq 0 iso 0 dist 8.99491 4.69203 8.75668 4.96726 9.67592 7.26966 6.84612 8.68586 4.97497 5.3948 numMergedOcc 0
5 mol 75 unq 0 iso 0 dist 6.95595 4.18109 9.20448 12.7957 7.79912 14.2474 8.91765 5.15851 8.88127 10.0425 numMergedOcc 0
6 mol 75 unq 1 iso 0 dist 6.95595 4.18109 9.20448 10.309 8.56639 12.103 8.91765 5.15851 8.88127 11.8774 numMergedOcc 0
7 mol 75 unq 2 iso 0 dist 6.95595 4.18109 9.20448 5.80162 8.59017 5.76778 8.91765 5.15851 8.88127 10.0372 numMergedOcc 0
8 mol 75 unq 3 iso 0 dist 6.95595 4.01868 6.96759 12.7957 7.79912 13.8905 8.91765 5.15851 6.78257 10.0425 numMergedOcc 0
9 mol 75 unq 4 iso 0 dist 6.95595 4.01868 6.96759 10.309 8.56639 12.899 8.91765 5.15851 6.78257 11.8774 numMergedOcc 0
10 mol 75 unq 5 iso 0 dist 6.95595 4.01868 6.96759 5.80162 8.59017 8.41332 8.91765 5.15851 6.78257 10.0372 numMergedOcc 0
11 mol 75 unq 6 iso 0 dist 6.95595 6.54389 6.97318 12.7957 7.79912 11.2774 8.91765 5.15851 4.7798 10.0425 numMergedOcc 0
12 mol 75 unq 7 iso 0 dist 6.95595 6.54389 6.97318 10.309 8.56639 11.0206 8.91765 5.15851 4.7798 11.8774 numMergedOcc 0
13 mol 75 unq 8 iso 0 dist 6.95595 6.54389 6.97318 5.80162 8.59017 6.56982 8.91765 5.15851 4.7798 10.0372 numMergedOcc 0
14 mol 109 unq 0 iso 0 dist 8.3164 12.6973 9.41191 11.5656 8.69985 12.7291 5.49138 5.87358 7.32599 9.46098 numMergedOcc 0
15 mol 133 unq 0 iso 0 dist 5.86531 4.98521 9.47554 6.26797 7.11802 5.34829 5.80615 7.92688 6.61857 4.68409 numMergedOcc 0
16 mol 133 unq 1 iso 0 dist 5.86531 4.98521 9.47554 9.73435 8.00618 9.67676 5.80615 7.92688 6.61857 12.2037 numMergedOcc 0
17 mol 134 unq 0 iso 0 dist 9.92932 5.73962 9.16358 10.5108 8.94367 10.0911 6.27009 8.79571 5.0903 5.41704 numMergedOcc 0
18 mol 134 unq 1 iso 0 dist 9.92932 5.73962 9.16358 6.20443 9.86662 9.66197 6.27009 8.79571 5.0903 6.17103 numMergedOcc 0
19 mol 134 unq 2 iso 0 dist 9.60411 5.73962 6.48328 10.5108 6.37586 10.0911 6.27009 5.42582 5.0903 5.41704 numMergedOcc 0
20 mol 134 unq 3 iso 0 dist 9.60411 5.73962 6.48328 6.20443 9.71307 9.66197 6.27009 5.42582 5.0903 6.17103 numMergedOcc 0
21 mol 134 unq 4 iso 0 dist 9.55556 10.971 9.16358 11.9294 8.94367 10.0911 10.2625 8.79571 5.0903 5.41704 numMergedOcc 0
22 mol 134 unq 5 iso 0 dist 9.55556 10.971 9.16358 6.36794 9.86662 9.66197 10.2625 8.79571 5.0903 6.17103 numMergedOcc 0
23 mol 152 unq 0 iso 0 dist 8.07256 4.81561 8.41774 10.4039 8.56324 13.1435 6.51591 9.13561 10.8622 5.99333 numMergedOcc 0
24 mol 152 unq 1 iso 0 dist 8.07256 4.81561 8.41774 11.1874 6.70283 13.793 6.51591 9.13561 10.8622 8.25411 numMergedOcc 0
25 mol 152 unq 2 iso 0 dist 8.07256 4.81561 8.41774 8.36099 7.16148 11.2124 6.51591 9.13561 10.8622 7.89109 numMergedOcc 0
26 mol 205 unq 0 iso 0 dist 5.96555 4.12904 8.52924 4.6995 6.03031 7.17157 12.5517 9.19704 15.3503 8.66809 numMergedOcc 0
27 mol 205 unq 1 iso 0 dist 5.96555 4.12904 8.52924 10.7091 7.26832 11.993 12.5517 9.19704 15.3503 6.23291 numMergedOcc 0
28 mol 205 unq 2 iso 0 dist 5.96555 4.12904 8.52924 5.87892 7.80463 9.67882 12.5517 9.19704 15.3503 13.231 numMergedOcc 0
29 mol 214 unq 0 iso 0 dist 9.51764 8.79059 9.92165 6.28065 9.65138 10.1227 6.09245 6.97182 4.40728 6.16485 numMergedOcc 0
30 mol 214 unq 1 iso 0 dist 9.51764 8.79059 9.92165 6.28065 9.65138 10.1227 10.8345 6.1175 5.75872 11.5712 numMergedOcc 0
31 mol 214 unq 2 iso 0 dist 9.51764 8.79059 9.92165 11.2159 7.14453 6.83063 6.09245 6.97182 4.40728 5.33565 numMergedOcc 0
32 mol 214 unq 3 iso 0 dist 9.51764 8.79059 9.92165 11.2159 7.14453 6.83063 10.8345 6.1175 5.75872 5.06792 numMergedOcc 0
33 mol 214 unq 4 iso 0 dist 9.51764 8.79059 9.92165 6.53326 8.85478 12.7439 6.09245 6.97182 4.40728 8.47007 numMergedOcc 0
34 mol 214 unq 5 iso 0 dist 9.51764 8.79059 9.92165 6.53326 8.85478 12.7439 10.8345 6.1175 5.75872 12.8334 numMergedOcc 0
35 mol 214 unq 6 iso 0 dist 5.36829 10.6379 9.92165 11.7583 9.65138 10.1227 8.69149 6.97182 4.40728 6.16485 numMergedOcc 0
36 mol 214 unq 7 iso 0 dist 5.36829 10.6379 9.92165 11.7583 9.65138 10.1227 6.00706 6.1175 5.75872 11.5712 numMergedOcc 0
37 mol 214 unq 8 iso 0 dist 5.36829 10.6379 9.92165 4.98764 7.14453 6.83063 8.69149 6.97182 4.40728 5.33565 numMergedOcc 0
38 mol 214 unq 9 iso 0 dist 5.36829 10.6379 9.92165 4.98764 7.14453 6.83063 6.00706 6.1175 5.75872 5.06792 numMergedOcc 0
39 mol 214 unq 10 iso 0 dist 5.36829 10.6379 9.92165 12.3481 8.85478 12.7439 8.69149 6.97182 4.40728 8.47007 numMergedOcc 0
40 mol 214 unq 11 iso 0 dist 5.36829 10.6379 9.92165 12.3481 8.85478 12.7439 6.00706 6.1175 5.75872 12.8334 numMergedOcc 0
41 mol 249 unq 0 iso 0 dist 6.37672 7.08836 6.26142 9.07501 7.57994 5.59015 10.4294 8.83735 10.0505 5.23473 numMergedOcc 0
42 mol 249 unq 1 iso 0 dist 6.37672 7.08836 6.26142 4.24014 6.18582 4.77325 10.4294 8.83735 10.0505 7.38675 numMergedOcc 0
43 mol 249 unq 2 iso 0 dist 8.94023 9.91022 6.26142 9.53929 7.57994 5.59015 9.10124 8.83735 10.0505 5.23473 numMergedOcc 0
44 mol 249 unq 3 iso 0 dist 8.94023 9.91022 6.26142 5.36989 6.18582 4.77325 9.10124 8.83735 10.0505 7.38675 numMergedOcc 0
45 mol 277 unq 0 iso 0 dist 9.29635 12.5633 4.81916 10.8075 9.7748 7.94155 13.8592 9.41725 6.20663 6.58374 numMergedOcc 0
