0 mol 5 unq 0 iso 0 dist 5.2392 4.9568 3.33561 3.67097 7.50453 5.69239 numMergedOcc 0
1 mol 46 unq 0 iso 0 dist 8.55202 8.79378 9.44812 8.99132 5.4713 13.7135 numMergedOcc 0
2 mol 62 unq 0 iso 0 dist 7.30651 8.7531 10.1267 6.13411 8.93807 14.2729 numMergedOcc 0
3 mol 62 unq 1 iso 0 dist 7.30651 7.25138 5.98227 6.13411 8.93807 4.46067 numMergedOcc 0
4 mol 76 unq 0 iso 0 dist 6.63973 6.46582 3.35924 9.68005 5.45099 7.66068 numMergedOcc 0
5 mol 76 unq 1 iso 0 dist 6.63973 6.46582 3.35924 14.6547 8.44765 9.5043 numMergedOcc 0
6 mol 76 unq 2 iso 0 dist 6.63973 6.46582 3.35924 14.1202 9.06643 8.34132 numMergedOcc 0
7 mol 79 unq 0 iso 0 dist 8.57705 9.00872 7.0748 8.65738 8.18375 13.8238 numMergedOcc 0
8 mol 79 unq 1 iso 0 dist 7.58743 9.853 5.43879 5.73969 9.21761 12.9035 numMergedOcc 0
9 mol 98 unq 0 iso 0 dist 7.34638 9.68556 11.0062 13.4072 7.14813 15.8842 numMergedOcc 0
10 mol 113 unq 0 iso 0 dist 6.12348 7.08403 3.52445 3.77247 4.30875 7.02358 numMergedOcc 0
11 mol 113 unq 1 iso 0 dist 6.12348 7.08403 3.52445 13.3539 8.65807 11.6135 numMergedOcc 0
12 mol 127 unq 0 iso 0 dist 8.75894 8.94636 10.1848 4.58529 8.09691 12.5142 numMergedOcc 0
13 mol 168 unq 0 iso 0 dist 9.23064 8.97414 6.06538 7.13766 7.0961 5.86767 numMergedOcc 0
14 mol 168 unq 1 iso 0 dist 9.23064 8.97414 6.06538 7.29489 8.26768 10.293 numMergedOcc 0
15 mol 168 unq 2 iso 0 dist 9.23064 8.00063 13.0096 7.13766 7.0961 8.89343 numMergedOcc 0
16 mol 168 unq 3 iso 0 dist 9.23064 8.00063 13.0096 7.29489 8.26768 12.6485 numMergedOcc 0
17 mol 168 unq 4 iso 0 dist 7.30338 8.97414 9.99868 7.13766 8.21227 5.86767 numMergedOcc 0
18 mol 168 unq 5 iso 0 dist 7.30338 8.00063 3.5168 7.13766 8.21227 8.89343 numMergedOcc 0
19 mol 169 unq 0 iso 0 dist 6.27683 7.33643 3.59996 3.89732 4.11374 6.96715 numMergedOcc 0
20 mol 169 unq 1 iso 0 dist 6.27683 7.33643 3.59996 13.2558 8.37602 11.3131 numMergedOcc 0
21 mol 169 unq 2 iso 0 dist 6.00783 7.50458 9.60496 4.24401 8.6961 5.10589 numMergedOcc 0
22 mol 169 unq 3 iso 0 dist 6.00783 5.79554 10.5251 4.24401 8.6961 4.63336 numMergedOcc 0
23 mol 169 unq 4 iso 0 dist 6.00783 4.22003 8.67112 4.24401 8.6961 6.10715 numMergedOcc 0
24 mol 171 unq 0 iso 0 dist 6.51523 7.06555 7.20382 11.244 9.68512 10.6564 numMergedOcc 0
25 mol 184 unq 0 iso 0 dist 8.27396 9.10344 3.30691 9.10254 5.23187 8.53111 numMergedOcc 0
26 mol 186 unq 0 iso 0 dist 6.52441 6.99587 4.75583 12.7948 9.34653 14.0911 numMergedOcc 0
27 mol 186 unq 1 iso 0 dist 6.52441 4.37577 3.11607 12.7948 9.34653 11.9419 numMergedOcc 0
28 mol 192 unq 0 iso 0 dist 7.93715 5.05414 3.41605 9.20742 8.23162 8.79914 numMergedOcc 0
29 mol 192 unq 1 iso 0 dist 7.93715 7.16964 7.59825 9.20742 8.23162 12.3292 numMergedOcc 0
30 mol 233 unq 0 iso 0 dist 5.76164 9.69772 6.70299 4.45501 8.4338 11.3473 numMergedOcc 0
31 mol 235 unq 0 iso 0 dist 5.39924 9.82099 14.4239 6.13843 9.24564 11.8163 numMergedOcc 0
32 mol 285 unq 0 iso 0 dist 5.09181 5.28731 4.98469 5.00843 7.73438 8.80238 numMergedOcc 0
33 mol 285 unq 1 iso 0 dist 8.27917 6.73396 3.14843 7.01472 4.27826 5.88958 numMergedOcc 0
34 mol 285 unq 2 iso 0 dist 8.27917 6.73396 3.14843 11.0045 5.82074 7.78121 numMergedOcc 0
