0 mol 0 unq 0 iso 0 dist 7.37981 9.98828 7.19621 6.63977 7.40865 4.76647 numMergedOcc 0
1 mol 0 unq 0 iso 1 dist 7.19621 9.98828 7.37981 4.76647 7.40865 6.63977 numMergedOcc 0
2 mol 7 unq 0 iso 0 dist 8.23909 13.1307 6.72215 13.7145 6.02702 6.11915 numMergedOcc 0
3 mol 7 unq 0 iso 1 dist 6.72215 13.1307 8.23909 6.11915 6.02702 13.7145 numMergedOcc 0
4 mol 54 unq 0 iso 0 dist 6.59893 5.42328 5.59773 8.02105 7.21717 7.93241 numMergedOcc 0
5 mol 54 unq 0 iso 1 dist 5.59773 5.42328 6.59893 7.93241 7.21717 8.02105 numMergedOcc 0
6 mol 73 unq 0 iso 0 dist 6.89722 5.47475 7.26679 11.5412 9.24757 11.2253 numMergedOcc 0
7 mol 73 unq 0 iso 1 dist 7.26679 5.47475 6.89722 11.2253 9.24757 11.5412 numMergedOcc 0
8 mol 102 unq 0 iso 0 dist 9.01767 7.56811 9.80678 10.4216 8.31932 12.8733 numMergedOcc 0
9 mol 102 unq 0 iso 1 dist 9.80678 7.56811 9.01767 12.8733 8.31932 10.4216 numMergedOcc 0
10 mol 108 unq 0 iso 0 dist 7.29462 6.45014 5.4057 4.70778 9.01852 6.76634 numMergedOcc 0
11 mol 108 unq 0 iso 1 dist 5.4057 6.45014 7.29462 6.76634 9.01852 4.70778 numMergedOcc 0
12 mol 108 unq 1 iso 0 dist 7.29462 6.45014 5.4057 11.386 9.75958 6.17742 numMergedOcc 0
13 mol 108 unq 1 iso 1 dist 5.4057 6.45014 7.29462 6.17742 9.75958 11.386 numMergedOcc 0
14 mol 130 unq 0 iso 0 dist 7.83619 15.0214 9.91643 7.91054 7.96646 11.6197 numMergedOcc 0
15 mol 130 unq 0 iso 1 dist 9.91643 15.0214 7.83619 11.6197 7.96646 7.91054 numMergedOcc 0
16 mol 131 unq 0 iso 0 dist 8.97145 8.09035 6.5874 4.17212 8.70296 9.64263 numMergedOcc 0
17 mol 131 unq 0 iso 1 dist 6.5874 8.09035 8.97145 9.64263 8.70296 4.17212 numMergedOcc 0
18 mol 131 unq 1 iso 0 dist 8.97145 8.09035 6.5874 13.6005 9.25558 5.55307 numMergedOcc 0
19 mol 131 unq 1 iso 1 dist 6.5874 8.09035 8.97145 5.55307 9.25558 13.6005 numMergedOcc 0
20 mol 181 unq 0 iso 0 dist 7.44191 8.67658 6.00053 6.70394 6.46704 10.8517 numMergedOcc 0
21 mol 181 unq 0 iso 1 dist 6.00053 8.67658 7.44191 10.8517 6.46704 6.70394 numMergedOcc 0
22 mol 181 unq 1 iso 0 dist 7.44191 8.67658 6.00053 11.2787 6.59025 5.87168 numMergedOcc 0
23 mol 181 unq 1 iso 1 dist 6.00053 8.67658 7.44191 5.87168 6.59025 11.2787 numMergedOcc 0
24 mol 194 unq 0 iso 0 dist 7.32478 4.87816 9.48439 5.35575 8.29382 7.25062 numMergedOcc 0
25 mol 194 unq 0 iso 1 dist 9.48439 4.87816 7.32478 7.25062 8.29382 5.35575 numMergedOcc 0
26 mol 194 unq 1 iso 0 dist 7.32478 4.87816 9.48439 7.75447 6.72379 6.38935 numMergedOcc 0
27 mol 194 unq 1 iso 1 dist 9.48439 4.87816 7.32478 6.38935 6.72379 7.75447 numMergedOcc 0
28 mol 213 unq 0 iso 0 dist 4.58599 6.76201 8.78568 11.5146 8.14332 10.693 numMergedOcc 0
29 mol 213 unq 0 iso 1 dist 8.78568 6.76201 4.58599 10.693 8.14332 11.5146 numMergedOcc 0
30 mol 238 unq 0 iso 0 dist 9.31417 4.85921 5.56719 16.7165 9.24557 11.9863 numMergedOcc 0
31 mol 238 unq 0 iso 1 dist 5.56719 4.85921 9.31417 11.9863 9.24557 16.7165 numMergedOcc 0
32 mol 249 unq 0 iso 0 dist 7.29898 5.2966 8.91685 10.4369 5.48118 13.4788 numMergedOcc 0
33 mol 249 unq 0 iso 1 dist 8.91685 5.2966 7.29898 13.4788 5.48118 10.4369 numMergedOcc 0
34 mol 273 unq 0 iso 0 dist 7.89852 6.80715 9.96963 5.62662 9.18157 5.06747 numMergedOcc 0
35 mol 273 unq 0 iso 1 dist 9.96963 6.80715 7.89852 5.06747 9.18157 5.62662 numMergedOcc 0
36 mol 282 unq 0 iso 0 dist 5.67266 6.38894 5.80981 7.46507 9.0975 7.79565 numMergedOcc 0
37 mol 282 unq 0 iso 1 dist 5.80981 6.38894 5.67266 7.79565 9.0975 7.46507 numMergedOcc 0
38 mol 282 unq 1 iso 0 dist 5.67266 12.9312 9.63346 7.46507 9.0975 10.4926 numMergedOcc 0
39 mol 282 unq 1 iso 1 dist 9.63346 12.9312 5.67266 10.4926 9.0975 7.46507 numMergedOcc 0
40 mol 282 unq 1 iso 0 dist 5.80981 12.8857 9.63346 7.79565 9.0975 10.4926 numMergedOcc 0
41 mol 282 unq 1 iso 1 dist 9.63346 12.8857 5.80981 10.4926 9.0975 7.79565 numMergedOcc 0
