0 mol 0 unq 0 iso 0 dist 7.37981 9.98828 7.19621 12.7599 9.6994 9.95 6.63977 7.40865 4.76647 9.11323 numMergedOcc 0
1 mol 0 unq 0 iso 1 dist 7.19621 9.98828 7.37981 9.95 9.6994 12.7599 4.76647 7.40865 6.63977 9.11323 numMergedOcc 0
2 mol 0 unq 1 iso 0 dist 7.37981 9.98828 7.19621 13.3337 7.15528 6.83587 6.63977 7.40865 4.76647 9.46298 numMergedOcc 0
3 mol 0 unq 1 iso 1 dist 7.19621 9.98828 7.37981 6.83587 7.15528 13.3337 4.76647 7.40865 6.63977 9.46298 numMergedOcc 0
4 mol 7 unq 0 iso 0 dist 8.23909 13.1307 6.72215 13.823 9.60499 5.38502 13.7145 6.02702 6.11915 8.43473 numMergedOcc 0
5 mol 7 unq 0 iso 1 dist 6.72215 13.1307 8.23909 5.38502 9.60499 13.823 6.11915 6.02702 13.7145 8.43473 numMergedOcc 0
6 mol 54 unq 0 iso 0 dist 6.59893 5.42328 5.59773 11.9881 9.5589 13.9079 8.02105 7.21717 7.93241 15.293 numMergedOcc 0
7 mol 54 unq 0 iso 1 dist 5.59773 5.42328 6.59893 13.9079 9.5589 11.9881 7.93241 7.21717 8.02105 15.293 numMergedOcc 0
8 mol 54 unq 1 iso 0 dist 6.59893 5.42328 5.59773 10.3564 6.83299 10.4238 8.02105 7.21717 7.93241 13.86 numMergedOcc 0
9 mol 54 unq 1 iso 1 dist 5.59773 5.42328 6.59893 10.4238 6.83299 10.3564 7.93241 7.21717 8.02105 13.86 numMergedOcc 0
10 mol 54 unq 2 iso 0 dist 6.59893 5.42328 5.59773 12.4254 8.10861 10.1356 8.02105 7.21717 7.93241 5.99981 numMergedOcc 0
11 mol 54 unq 2 iso 1 dist 5.59773 5.42328 6.59893 10.1356 8.10861 12.4254 7.93241 7.21717 8.02105 5.99981 numMergedOcc 0
12 mol 73 unq 0 iso 0 dist 6.89722 5.47475 7.26679 10.4716 9.96396 8.31041 11.5412 9.24757 11.2253 5.11416 numMergedOcc 0
13 mol 73 unq 0 iso 1 dist 7.26679 5.47475 6.89722 8.31041 9.96396 10.4716 11.2253 9.24757 11.5412 5.11416 numMergedOcc 0
14 mol 73 unq 1 iso 0 dist 6.89722 5.47475 7.26679 5.2774 6.19304 5.44275 11.5412 9.24757 11.2253 6.56633 numMergedOcc 0
15 mol 73 unq 1 iso 1 dist 7.26679 5.47475 6.89722 5.44275 6.19304 5.2774 11.2253 9.24757 11.5412 6.56633 numMergedOcc 0
16 mol 73 unq 2 iso 0 dist 6.89722 5.47475 7.26679 13.9156 8.70481 11.2674 11.5412 9.24757 11.2253 15.3808 numMergedOcc 0
17 mol 73 unq 2 iso 1 dist 7.26679 5.47475 6.89722 11.2674 8.70481 13.9156 11.2253 9.24757 11.5412 15.3808 numMergedOcc 0
18 mol 102 unq 0 iso 0 dist 9.01767 7.56811 9.80678 6.42572 7.36792 5.54551 10.4216 8.31932 12.8733 7.42011 numMergedOcc 0
19 mol 102 unq 0 iso 1 dist 9.80678 7.56811 9.01767 5.54551 7.36792 6.42572 12.8733 8.31932 10.4216 7.42011 numMergedOcc 0
20 mol 130 unq 0 iso 0 dist 7.83619 15.0214 9.91643 10.0837 9.28393 7.40242 7.91054 7.96646 11.6197 6.73735 numMergedOcc 0
21 mol 130 unq 0 iso 1 dist 9.91643 15.0214 7.83619 7.40242 9.28393 10.0837 11.6197 7.96646 7.91054 6.73735 numMergedOcc 0
22 mol 131 unq 0 iso 0 dist 8.97145 8.09035 6.5874 14.257 6.85062 7.60371 4.17212 8.70296 9.64263 14.2045 numMergedOcc 0
23 mol 131 unq 0 iso 1 dist 6.5874 8.09035 8.97145 7.60371 6.85062 14.257 9.64263 8.70296 4.17212 14.2045 numMergedOcc 0
24 mol 131 unq 1 iso 0 dist 8.97145 8.09035 6.5874 14.257 6.85062 7.60371 13.6005 9.25558 5.55307 5.09131 numMergedOcc 0
25 mol 131 unq 1 iso 1 dist 6.5874 8.09035 8.97145 7.60371 6.85062 14.257 5.55307 9.25558 13.6005 5.09131 numMergedOcc 0
26 mol 181 unq 0 iso 0 dist 7.44191 8.67658 6.00053 9.60754 8.03334 11.1879 6.70394 6.46704 10.8517 4.43096 numMergedOcc 0
27 mol 181 unq 0 iso 1 dist 6.00053 8.67658 7.44191 11.1879 8.03334 9.60754 10.8517 6.46704 6.70394 4.43096 numMergedOcc 0
28 mol 181 unq 1 iso 0 dist 7.44191 8.67658 6.00053 9.60754 8.03334 11.1879 11.2787 6.59025 5.87168 8.04639 numMergedOcc 0
29 mol 181 unq 1 iso 1 dist 6.00053 8.67658 7.44191 11.1879 8.03334 9.60754 5.87168 6.59025 11.2787 8.04639 numMergedOcc 0
30 mol 238 unq 0 iso 0 dist 9.31417 4.85921 5.56719 6.62361 5.72887 5.96552 16.7165 9.24557 11.9863 14.7883 numMergedOcc 0
31 mol 238 unq 0 iso 1 dist 5.56719 4.85921 9.31417 5.96552 5.72887 6.62361 11.9863 9.24557 16.7165 14.7883 numMergedOcc 0
32 mol 249 unq 0 iso 0 dist 7.29898 5.2966 8.91685 6.6173 7.57994 5.25611 10.4369 5.48118 13.4788 10.7772 numMergedOcc 0
33 mol 249 unq 0 iso 1 dist 8.91685 5.2966 7.29898 5.25611 7.57994 6.6173 13.4788 5.48118 10.4369 10.7772 numMergedOcc 0
34 mol 249 unq 1 iso 0 dist 7.29898 5.2966 8.91685 8.95486 6.18582 9.66184 10.4369 5.48118 13.4788 7.04666 numMergedOcc 0
35 mol 249 unq 1 iso 1 dist 8.91685 5.2966 7.29898 9.66184 6.18582 8.95486 13.4788 5.48118 10.4369 7.04666 numMergedOcc 0
36 mol 282 unq 0 iso 0 dist 5.67266 6.38894 5.80981 9.63727 8.04483 9.60898 7.46507 9.0975 7.79565 5.65568 numMergedOcc 0
37 mol 282 unq 0 iso 1 dist 5.80981 6.38894 5.67266 9.60898 8.04483 9.63727 7.79565 9.0975 7.46507 5.65568 numMergedOcc 0
38 mol 282 unq 1 iso 0 dist 5.67266 6.38894 5.80981 4.58403 8.76532 10.5698 7.46507 9.0975 7.79565 8.12478 numMergedOcc 0
39 mol 282 unq 1 iso 1 dist 5.80981 6.38894 5.67266 10.5698 8.76532 4.58403 7.79565 9.0975 7.46507 8.12478 numMergedOcc 0
40 mol 282 unq 2 iso 0 dist 5.67266 6.38894 5.80981 5.04235 6.33524 8.37652 7.46507 9.0975 7.79565 5.0324 numMergedOcc 0
41 mol 282 unq 2 iso 1 dist 5.80981 6.38894 5.67266 8.37652 6.33524 5.04235 7.79565 9.0975 7.46507 5.0324 numMergedOcc 0
42 mol 282 unq 3 iso 0 dist 5.67266 12.9312 9.63346 9.63727 8.04483 4.85461 7.46507 9.0975 10.4926 5.65568 numMergedOcc 0
43 mol 282 unq 3 iso 1 dist 9.63346 12.9312 5.67266 4.85461 8.04483 9.63727 10.4926 9.0975 7.46507 5.65568 numMergedOcc 0
44 mol 282 unq 4 iso 0 dist 5.67266 12.9312 9.63346 4.58403 8.76532 13.108 7.46507 9.0975 10.4926 8.12478 numMergedOcc 0
45 mol 282 unq 4 iso 1 dist 9.63346 12.9312 5.67266 13.108 8.76532 4.58403 10.4926 9.0975 7.46507 8.12478 numMergedOcc 0
46 mol 282 unq 5 iso 0 dist 5.67266 12.9312 9.63346 5.04235 6.33524 8.85797 7.46507 9.0975 10.4926 5.0324 numMergedOcc 0
47 mol 282 unq 5 iso 1 dist 9.63346 12.9312 5.67266 8.85797 6.33524 5.04235 10.4926 9.0975 7.46507 5.0324 numMergedOcc 0
48 mol 282 unq 3 iso 0 dist 5.80981 12.8857 9.63346 9.60898 8.04483 4.85461 7.79565 9.0975 10.4926 5.65568 numMergedOcc 0
49 mol 282 unq 3 iso 1 dist 9.63346 12.8857 5.80981 4.85461 8.04483 9.60898 10.4926 9.0975 7.79565 5.65568 numMergedOcc 0
50 mol 282 unq 4 iso 0 dist 5.80981 12.8857 9.63346 10.5698 8.76532 13.108 7.79565 9.0975 10.4926 8.12478 numMergedOcc 0
51 mol 282 unq 4 iso 1 dist 9.63346 12.8857 5.80981 13.108 8.76532 10.5698 10.4926 9.0975 7.79565 8.12478 numMergedOcc 0
52 mol 282 unq 5 iso 0 dist 5.80981 12.8857 9.63346 8.37652 6.33524 8.85797 7.79565 9.0975 10.4926 5.0324 numMergedOcc 0
53 mol 282 unq 5 iso 1 dist 9.63346 12.8857 5.80981 8.85797 6.33524 8.37652 10.4926 9.0975 7.79565 5.0324 numMergedOcc 0
