0 mol 21 unq 0 iso 0 dist 9.36951 9.3973 6.37687 10.706 9.83589 15.1474 numMergedOcc 0
1 mol 30 unq 0 iso 0 dist 8.87499 8.3224 5.38977 8.43217 9.03928 8.23784 numMergedOcc 0
2 mol 30 unq 1 iso 0 dist 8.87499 8.71602 5.29629 8.43217 9.03928 12.9185 numMergedOcc 0
3 mol 30 unq 2 iso 0 dist 8.87499 7.54379 9.17076 8.43217 9.03928 14.1644 numMergedOcc 0
4 mol 30 unq 3 iso 0 dist 8.2359 8.3224 5.85756 10.0107 9.83449 7.27243 numMergedOcc 0
5 mol 30 unq 4 iso 0 dist 8.2359 8.71602 10.1951 10.0107 9.83449 13.7441 numMergedOcc 0
6 mol 30 unq 5 iso 0 dist 8.2359 7.54379 8.04261 10.0107 9.83449 14.6528 numMergedOcc 0
7 mol 68 unq 0 iso 0 dist 6.43426 6.72469 6.73987 3.62638 8.8014 5.7369 numMergedOcc 0
8 mol 73 unq 0 iso 0 dist 8.54468 7.10218 12.2009 5.42116 6.22872 11.8876 numMergedOcc 0
9 mol 78 unq 0 iso 0 dist 6.53892 9.6088 4.63543 8.88187 7.94467 11.7366 numMergedOcc 0
10 mol 115 unq 0 iso 0 dist 5.96762 8.54304 3.85674 6.67039 6.17349 9.0534 numMergedOcc 0
11 mol 115 unq 1 iso 0 dist 5.96762 8.54304 3.85674 9.02908 9.21978 7.65564 numMergedOcc 0
12 mol 141 unq 0 iso 0 dist 8.76784 5.05627 6.90735 6.83215 4.54218 7.92216 numMergedOcc 0
13 mol 169 unq 0 iso 0 dist 8.51999 8.89822 7.26442 6.37039 8.66311 11.3115 numMergedOcc 0
14 mol 186 unq 0 iso 0 dist 8.30192 8.9388 5.72704 6.21482 8.28282 9.98715 numMergedOcc 0
15 mol 186 unq 1 iso 0 dist 7.76429 9.16579 10.1836 11.8416 7.81696 17.6672 numMergedOcc 0
16 mol 186 unq 2 iso 0 dist 7.76429 8.95209 12.4955 11.8416 7.81696 17.1125 numMergedOcc 0
17 mol 235 unq 0 iso 0 dist 6.69765 6.92276 5.66713 7.00699 9.20504 8.85214 numMergedOcc 0
18 mol 235 unq 1 iso 0 dist 6.69765 6.92276 5.66713 7.69605 6.15704 5.1874 numMergedOcc 0
19 mol 235 unq 2 iso 0 dist 5.99439 8.75776 5.66713 5.08355 9.20504 8.85214 numMergedOcc 0
20 mol 235 unq 3 iso 0 dist 5.99439 8.75776 5.66713 6.1439 6.15704 5.1874 numMergedOcc 0
21 mol 243 unq 0 iso 0 dist 8.10349 9.30388 3.98086 5.76716 8.8602 8.30024 numMergedOcc 0
22 mol 243 unq 1 iso 0 dist 8.10349 8.96099 4.02386 5.76716 8.8602 8.20943 numMergedOcc 0
23 mol 243 unq 2 iso 0 dist 9.62793 9.30388 4.03312 5.76716 7.13476 8.30024 numMergedOcc 0
24 mol 243 unq 3 iso 0 dist 9.62793 8.96099 9.0802 5.76716 7.13476 8.20943 numMergedOcc 0
25 mol 243 unq 4 iso 0 dist 6.33501 5.78671 6.42369 9.67191 8.8602 13.5858 numMergedOcc 0
26 mol 243 unq 5 iso 0 dist 6.33501 6.56525 4.02386 9.67191 8.8602 8.20943 numMergedOcc 0
27 mol 243 unq 6 iso 0 dist 6.33501 5.46817 8.36019 9.67191 8.8602 12.9457 numMergedOcc 0
28 mol 243 unq 7 iso 0 dist 6.67803 5.78671 8.94826 9.67191 9.49016 13.5858 numMergedOcc 0
29 mol 243 unq 8 iso 0 dist 6.67803 5.78671 8.94826 10.0028 8.92798 15.2293 numMergedOcc 0
30 mol 243 unq 9 iso 0 dist 6.67803 6.56525 6.41173 9.67191 9.49016 8.20943 numMergedOcc 0
31 mol 243 unq 10 iso 0 dist 6.67803 6.56525 6.41173 10.0028 8.92798 11.5417 numMergedOcc 0
32 mol 243 unq 11 iso 0 dist 6.67803 5.46817 5.7044 9.67191 9.49016 12.9457 numMergedOcc 0
33 mol 243 unq 12 iso 0 dist 6.67803 5.46817 5.7044 10.0028 8.92798 13.3088 numMergedOcc 0
