0 mol 24 unq 0 iso 0 dist 8.3964 10.6642 4.90592 7.84552 3.4435 4.87192 numMergedOcc 0
1 mol 24 unq 1 iso 0 dist 8.3964 8.81498 9.36461 13.5873 11.3314 5.47982 numMergedOcc 0
2 mol 27 unq 0 iso 0 dist 7.96312 4.7474 7.45532 8.57551 5.92112 7.43804 numMergedOcc 0
3 mol 27 unq 1 iso 0 dist 7.67129 9.37609 7.45532 9.32506 5.92112 7.43804 numMergedOcc 0
4 mol 73 unq 0 iso 0 dist 6.66506 5.67493 6.48232 7.55565 4.10173 9.22853 numMergedOcc 0
5 mol 73 unq 1 iso 0 dist 6.82707 10.7046 8.39326 18.1584 16.0412 8.3921 numMergedOcc 0
6 mol 85 unq 0 iso 0 dist 9.18097 11.155 8.70863 12.0044 4.58085 6.00564 numMergedOcc 0
7 mol 85 unq 1 iso 0 dist 8.83135 15.3247 8.70863 10.1106 4.58085 6.00564 numMergedOcc 0
8 mol 92 unq 0 iso 0 dist 6.6186 5.00872 8.57827 13.4599 11.3027 9.93806 numMergedOcc 0
9 mol 109 unq 0 iso 0 dist 9.13614 5.02505 6.76575 11.008 4.31811 7.04752 numMergedOcc 0
10 mol 120 unq 0 iso 0 dist 8.64019 6.87987 6.03352 6.28208 6.93115 9.23243 numMergedOcc 0
11 mol 162 unq 0 iso 0 dist 6.80226 6.62679 7.58035 9.98649 6.49195 6.0532 numMergedOcc 0
12 mol 162 unq 1 iso 0 dist 9.31025 7.6506 7.14263 7.80955 8.06906 6.00293 numMergedOcc 0
13 mol 162 unq 2 iso 0 dist 9.0087 8.07237 7.14263 13.4949 8.06906 6.00293 numMergedOcc 0
14 mol 162 unq 3 iso 0 dist 8.11292 13.9849 8.57005 13.0314 6.76865 6.00293 numMergedOcc 0
15 mol 162 unq 4 iso 0 dist 8.54006 7.2417 8.57005 6.66396 6.76865 6.00293 numMergedOcc 0
16 mol 205 unq 0 iso 0 dist 6.23057 8.43505 5.95375 11.7345 11.0113 9.85415 numMergedOcc 0
17 mol 205 unq 1 iso 0 dist 6.23057 8.43505 5.95375 9.49617 3.5693 5.96238 numMergedOcc 0
18 mol 205 unq 2 iso 0 dist 6.23057 8.43505 5.95375 11.4912 6.29383 8.24405 numMergedOcc 0
19 mol 205 unq 3 iso 0 dist 6.23057 11.501 9.17946 11.7345 11.0113 6.61806 numMergedOcc 0
20 mol 205 unq 4 iso 0 dist 6.23057 11.501 9.17946 9.49617 3.5693 7.85966 numMergedOcc 0
21 mol 230 unq 0 iso 0 dist 8.85051 5.02022 6.34832 7.5725 6.78617 7.81987 numMergedOcc 0
22 mol 272 unq 0 iso 0 dist 8.86801 15.7876 8.13034 14.2894 8.47076 9.28899 numMergedOcc 0
23 mol 272 unq 1 iso 0 dist 7.15093 11.2381 8.13034 12.7154 8.47076 9.28899 numMergedOcc 0
24 mol 282 unq 0 iso 0 dist 8.42086 10.796 8.67489 15.7414 13.6597 7.44686 numMergedOcc 0
25 mol 282 unq 1 iso 0 dist 8.42086 10.796 8.67489 17.8118 17.0693 9.82855 numMergedOcc 0
26 mol 282 unq 2 iso 0 dist 8.42086 10.796 8.67489 19.0631 16.027 8.62579 numMergedOcc 0
27 mol 282 unq 3 iso 0 dist 7.84236 13.26 8.67489 18.9712 13.6597 7.44686 numMergedOcc 0
28 mol 282 unq 4 iso 0 dist 7.84236 13.26 8.67489 21.5466 17.0693 9.82855 numMergedOcc 0
29 mol 282 unq 5 iso 0 dist 7.84236 13.26 8.67489 21.7756 16.027 8.62579 numMergedOcc 0
