0 mol 24 unq 0 iso 0 dist 8.15652 6.14164 9.40479 8.92687 4.90592 6.99746 numMergedOcc 0
1 mol 24 unq 1 iso 0 dist 8.15652 6.14164 9.40479 5.12527 8.16324 7.05541 numMergedOcc 0
2 mol 24 unq 2 iso 0 dist 8.15652 13.4279 9.58012 8.92687 4.90592 11.8996 numMergedOcc 0
3 mol 24 unq 3 iso 0 dist 8.15652 13.4279 9.58012 5.12527 8.16324 9.15493 numMergedOcc 0
4 mol 24 unq 4 iso 0 dist 6.44893 11.8013 9.40479 6.2838 4.90592 6.99746 numMergedOcc 0
5 mol 24 unq 5 iso 0 dist 6.44893 11.8013 9.40479 11.8259 8.16324 7.05541 numMergedOcc 0
6 mol 24 unq 6 iso 0 dist 6.44893 8.65417 9.58012 6.2838 4.90592 11.8996 numMergedOcc 0
7 mol 24 unq 7 iso 0 dist 6.44893 8.65417 9.58012 11.8259 8.16324 9.15493 numMergedOcc 0
8 mol 34 unq 0 iso 0 dist 8.72742 11.6716 8.63361 13.3807 6.15801 5.89577 numMergedOcc 0
9 mol 34 unq 1 iso 0 dist 8.72742 11.6716 8.63361 14.8083 9.63403 6.62645 numMergedOcc 0
10 mol 34 unq 2 iso 0 dist 8.72742 11.6716 8.63361 5.89131 8.07314 6.27366 numMergedOcc 0
11 mol 98 unq 0 iso 0 dist 9.17137 15.168 7.63183 15.1795 6.62972 9.50457 numMergedOcc 0
12 mol 109 unq 0 iso 0 dist 9.9387 18.7871 9.92553 9.58922 6.76575 10.9279 numMergedOcc 0
13 mol 131 unq 0 iso 0 dist 8.51895 5.8592 7.76594 5.7124 5.39061 5.66194 numMergedOcc 0
14 mol 163 unq 0 iso 0 dist 8.74174 12.5106 7.3546 5.81031 9.79069 15.9955 numMergedOcc 0
15 mol 163 unq 1 iso 0 dist 8.74174 12.5106 7.3546 11.0152 9.27496 5.87447 numMergedOcc 0
16 mol 193 unq 0 iso 0 dist 9.19696 6.65303 5.44396 4.40489 7.8141 6.03632 numMergedOcc 0
17 mol 193 unq 1 iso 0 dist 9.19696 6.65303 5.44396 16.0236 8.43187 10.6169 numMergedOcc 0
18 mol 193 unq 2 iso 0 dist 9.19696 11.1693 6.22972 4.40489 7.8141 7.58433 numMergedOcc 0
19 mol 193 unq 3 iso 0 dist 9.19696 11.1693 6.22972 16.0236 8.43187 5.56664 numMergedOcc 0
20 mol 237 unq 0 iso 0 dist 9.57858 8.43171 9.53139 4.61626 9.54499 11.2776 numMergedOcc 0
21 mol 237 unq 1 iso 0 dist 9.57858 8.43171 9.53139 5.14102 9.36216 6.12402 numMergedOcc 0
22 mol 237 unq 2 iso 0 dist 6.96229 10.205 7.63812 4.61626 5.6703 5.90415 numMergedOcc 0
23 mol 237 unq 3 iso 0 dist 6.96229 10.205 7.63812 5.14102 8.72819 9.2471 numMergedOcc 0
24 mol 252 unq 0 iso 0 dist 9.45457 15.7765 8.55481 5.46761 7.39391 12.0545 numMergedOcc 0
25 mol 284 unq 0 iso 0 dist 8.79958 16.6767 7.97588 4.58432 9.63007 16.5329 numMergedOcc 0
