0 mol 43 unq 0 iso 0 dist 8.06275 5.5249 8.80331 8.60781 9.83618 10.4442 5.33298 8.95682 6.18002 4.54282 numMergedOcc 0
1 mol 43 unq 1 iso 0 dist 8.06275 10.4413 6.20293 8.60781 9.83618 9.49077 5.33298 8.95682 8.38399 4.54282 numMergedOcc 0
2 mol 43 unq 2 iso 0 dist 8.90024 13.9129 8.80331 12.664 9.83618 10.4442 13.2914 8.95682 6.18002 4.54282 numMergedOcc 0
3 mol 43 unq 3 iso 0 dist 8.90024 5.84171 6.20293 12.664 9.83618 9.49077 13.2914 8.95682 8.38399 4.54282 numMergedOcc 0
4 mol 58 unq 0 iso 0 dist 9.81637 11.9429 6.62496 10.5083 9.64665 4.67832 6.18332 5.93884 5.78774 5.27642 numMergedOcc 0
5 mol 72 unq 0 iso 0 dist 9.43143 10.5786 8.8178 12.1059 6.77912 12.0644 11.9655 9.27838 15.434 4.67641 numMergedOcc 0
6 mol 72 unq 1 iso 0 dist 9.43143 16.2349 9.96708 12.1059 6.77912 7.11552 11.9655 9.27838 11.6378 4.67641 numMergedOcc 0
7 mol 109 unq 0 iso 0 dist 9.26438 5.68669 8.69985 10.7144 5.87358 9.46098 5.26309 7.80523 7.74599 6.89298 numMergedOcc 0
8 mol 109 unq 1 iso 0 dist 6.43255 6.80429 8.69985 9.77909 5.87358 9.46098 11.4333 7.80523 7.74599 6.89298 numMergedOcc 0
9 mol 109 unq 2 iso 0 dist 7.4389 12.3794 8.69985 8.77144 5.87358 9.46098 14.0908 7.80523 7.74599 6.89298 numMergedOcc 0
10 mol 114 unq 0 iso 0 dist 6.71345 6.49725 7.5732 11.3386 8.71128 5.80557 8.84017 6.84011 7.436 9.23527 numMergedOcc 0
11 mol 134 unq 0 iso 0 dist 4.9155 9.30817 6.54501 13.386 8.6355 10.1448 6.64576 7.80532 7.41674 14.1488 numMergedOcc 0
12 mol 134 unq 1 iso 0 dist 4.9155 10.879 6.49416 13.386 8.6355 5.41704 6.64576 7.80532 9.87376 14.1488 numMergedOcc 0
13 mol 134 unq 2 iso 0 dist 8.49987 6.47843 6.54501 15.6111 8.6355 10.1448 5.54455 7.80532 7.41674 14.1488 numMergedOcc 0
14 mol 134 unq 3 iso 0 dist 8.49987 10.9399 6.49416 15.6111 8.6355 5.41704 5.54455 7.80532 9.87376 14.1488 numMergedOcc 0
15 mol 134 unq 4 iso 0 dist 9.42271 6.16353 6.54501 11.8215 8.6355 10.1448 5.87436 7.80532 7.41674 14.1488 numMergedOcc 0
16 mol 134 unq 5 iso 0 dist 9.42271 7.07625 6.49416 11.8215 8.6355 5.41704 5.87436 7.80532 9.87376 14.1488 numMergedOcc 0
17 mol 197 unq 0 iso 0 dist 7.70631 12.7195 8.56633 14.5382 8.99696 9.82139 14.5203 7.50013 8.46623 11.1666 numMergedOcc 0
18 mol 197 unq 1 iso 0 dist 7.70631 12.7195 8.56633 14.5382 8.99696 9.82139 11.199 5.81233 10.7305 13.3562 numMergedOcc 0
19 mol 197 unq 2 iso 0 dist 7.70631 12.7195 8.56633 14.5382 8.99696 9.82139 12.0358 6.92924 5.41996 4.59269 numMergedOcc 0
20 mol 197 unq 3 iso 0 dist 7.70631 12.7195 8.56633 14.5382 8.99696 9.82139 7.10431 7.14306 6.64537 12.9766 numMergedOcc 0
21 mol 197 unq 4 iso 0 dist 7.70631 12.7195 8.56633 12.215 7.85058 8.72637 14.5203 7.50013 8.46623 5.53129 numMergedOcc 0
22 mol 197 unq 5 iso 0 dist 7.70631 12.7195 8.56633 12.215 7.85058 8.72637 11.199 5.81233 10.7305 4.38296 numMergedOcc 0
23 mol 197 unq 6 iso 0 dist 7.70631 12.7195 8.56633 12.215 7.85058 8.72637 12.0358 6.92924 5.41996 11.3267 numMergedOcc 0
24 mol 197 unq 7 iso 0 dist 7.70631 12.7195 8.56633 12.215 7.85058 8.72637 7.10431 7.14306 6.64537 8.05362 numMergedOcc 0
25 mol 197 unq 8 iso 0 dist 7.70631 12.7195 8.56633 16.4731 9.96638 5.69148 14.5203 7.50013 8.46623 6.46195 numMergedOcc 0
26 mol 197 unq 9 iso 0 dist 7.70631 12.7195 8.56633 16.4731 9.96638 5.69148 11.199 5.81233 10.7305 11.0356 numMergedOcc 0
27 mol 197 unq 10 iso 0 dist 7.70631 12.7195 8.56633 16.4731 9.96638 5.69148 12.0358 6.92924 5.41996 6.31157 numMergedOcc 0
28 mol 197 unq 11 iso 0 dist 7.70631 12.7195 8.56633 16.4731 9.96638 5.69148 7.10431 7.14306 6.64537 11.5276 numMergedOcc 0
29 mol 209 unq 0 iso 0 dist 5.92907 5.35615 7.56373 10.2593 7.95911 7.19056 9.57857 6.85935 6.552 5.50596 numMergedOcc 0
30 mol 235 unq 0 iso 0 dist 7.8128 5.49043 5.4638 7.62542 9.58736 9.66021 12.5723 9.55668 7.60081 13.128 numMergedOcc 0
31 mol 264 unq 0 iso 0 dist 7.37999 4.72487 9.361 11.9746 9.0012 9.74238 10.9458 7.16853 11.1431 9.76317 numMergedOcc 0
32 mol 264 unq 1 iso 0 dist 7.37999 4.72487 9.361 11.2015 9.5784 9.85579 10.9458 7.16853 11.1431 13.9064 numMergedOcc 0
33 mol 264 unq 2 iso 0 dist 7.37999 11.0659 6.24356 11.9746 9.0012 5.12409 10.9458 7.16853 5.00209 9.76317 numMergedOcc 0
34 mol 264 unq 3 iso 0 dist 7.37999 11.0659 6.24356 11.2015 9.5784 9.67998 10.9458 7.16853 5.00209 13.9064 numMergedOcc 0
35 mol 264 unq 4 iso 0 dist 7.36703 5.28781 9.361 7.25333 9.0012 9.74238 6.24807 7.16853 11.1431 9.76317 numMergedOcc 0
36 mol 264 unq 5 iso 0 dist 7.36703 5.28781 9.361 10.3867 9.5784 9.85579 6.24807 7.16853 11.1431 13.9064 numMergedOcc 0
37 mol 264 unq 6 iso 0 dist 7.36703 5.91731 6.24356 7.25333 9.0012 5.12409 6.24807 7.16853 5.00209 9.76317 numMergedOcc 0
38 mol 264 unq 7 iso 0 dist 7.36703 5.91731 6.24356 10.3867 9.5784 9.67998 6.24807 7.16853 5.00209 13.9064 numMergedOcc 0
39 mol 278 unq 0 iso 0 dist 9.91518 12.8387 8.44326 7.70648 6.35287 6.07447 11.8916 8.00673 4.97614 7.83538 numMergedOcc 0
