0 mol 14 unq 0 iso 0 dist 9.28341 4.97366 6.87018 12.5091 8.39221 10.5329 numMergedOcc 0
1 mol 26 unq 0 iso 0 dist 8.54885 5.08675 6.89136 6.89195 8.94292 6.90106 numMergedOcc 0
2 mol 26 unq 1 iso 0 dist 8.54885 5.08675 6.89136 7.78176 7.14934 5.56136 numMergedOcc 0
3 mol 43 unq 0 iso 0 dist 8.06275 6.41579 8.38387 5.71662 9.74445 7.67926 numMergedOcc 0
4 mol 43 unq 1 iso 0 dist 8.90024 14.9559 8.38387 18.5048 9.74445 7.67926 numMergedOcc 0
5 mol 58 unq 0 iso 0 dist 9.81637 9.37897 6.36193 4.95437 7.84983 7.63046 numMergedOcc 0
6 mol 69 unq 0 iso 0 dist 6.92837 5.10938 9.8809 5.74577 9.57969 10.5183 numMergedOcc 0
7 mol 92 unq 0 iso 0 dist 9.96446 5.27016 8.4545 14.2688 7.86724 9.84923 numMergedOcc 0
8 mol 110 unq 0 iso 0 dist 7.77678 4.9839 9.73174 11.5698 5.25492 11.3462 numMergedOcc 0
9 mol 110 unq 1 iso 0 dist 7.77678 4.36119 9.65418 11.5698 5.25492 12.1775 numMergedOcc 0
10 mol 122 unq 0 iso 0 dist 8.47907 5.08302 9.40018 6.85647 8.33083 3.45209 numMergedOcc 0
11 mol 122 unq 1 iso 0 dist 8.47907 11.2519 6.78949 6.85647 8.33083 9.13822 numMergedOcc 0
12 mol 152 unq 0 iso 0 dist 8.34839 6.11789 8.07256 5.80854 9.10619 8.50267 numMergedOcc 0
13 mol 176 unq 0 iso 0 dist 8.78509 13.7707 7.30954 12.526 9.03194 8.67242 numMergedOcc 0
14 mol 186 unq 0 iso 0 dist 9.52413 16.5529 8.03995 4.62432 7.66381 14.6683 numMergedOcc 0
15 mol 196 unq 0 iso 0 dist 9.36732 5.01554 8.79558 7.21567 6.76923 3.60144 numMergedOcc 0
16 mol 206 unq 0 iso 0 dist 5.82039 8.60571 9.78438 10.3181 8.31638 10.2556 numMergedOcc 0
17 mol 206 unq 1 iso 0 dist 5.82039 8.60571 9.78438 8.09615 9.72979 4.58247 numMergedOcc 0
18 mol 236 unq 0 iso 0 dist 7.49412 10.8749 7.89744 11.7007 9.31246 5.972 numMergedOcc 0
19 mol 236 unq 1 iso 0 dist 7.49412 7.38199 8.6417 11.7007 9.31246 5.91643 numMergedOcc 0
20 mol 238 unq 0 iso 0 dist 9.39537 6.43015 6.24928 6.39493 9.75174 9.87348 numMergedOcc 0
21 mol 239 unq 0 iso 0 dist 8.82778 12.0443 6.44212 12.7518 6.37342 11.0479 numMergedOcc 0
22 mol 241 unq 0 iso 0 dist 8.23536 9.23513 9.10633 4.56189 9.72526 11.4382 numMergedOcc 0
23 mol 241 unq 1 iso 0 dist 6.90245 3.92006 9.10633 10.121 9.72526 11.4382 numMergedOcc 0
24 mol 251 unq 0 iso 0 dist 9.70918 6.79021 8.39644 10.0566 9.82043 8.59586 numMergedOcc 0
25 mol 277 unq 0 iso 0 dist 7.151 12.4082 9.77689 13.1772 9.98528 7.41383 numMergedOcc 0
26 mol 277 unq 1 iso 0 dist 7.151 7.47195 8.51931 13.1772 9.98528 17.1833 numMergedOcc 0
27 mol 277 unq 2 iso 0 dist 8.53324 7.47195 8.96343 7.09461 9.02914 13.4151 numMergedOcc 0
28 mol 277 unq 3 iso 0 dist 7.23956 12.7088 9.29635 7.09461 6.90434 15.5244 numMergedOcc 0
29 mol 277 unq 4 iso 0 dist 8.33977 14.7999 9.77689 17.7336 9.98528 7.41383 numMergedOcc 0
30 mol 277 unq 5 iso 0 dist 8.33977 5.65499 8.51931 17.7336 9.98528 17.1833 numMergedOcc 0
31 mol 277 unq 6 iso 0 dist 8.66941 5.65499 8.96343 16.013 9.02914 13.4151 numMergedOcc 0
