0 mol 30 unq 0 iso 0 dist 8.87499 8.3224 5.38977 10.0107 9.89655 7.27243 numMergedOcc 0
1 mol 30 unq 1 iso 0 dist 8.87499 8.3224 5.38977 8.43217 9.03928 8.23784 numMergedOcc 0
2 mol 30 unq 2 iso 0 dist 8.2359 8.3224 5.85756 10.0107 9.83449 7.27243 numMergedOcc 0
3 mol 30 unq 3 iso 0 dist 8.2359 8.3224 5.85756 8.43217 11.1773 8.23784 numMergedOcc 0
4 mol 34 unq 0 iso 0 dist 9.32818 5.39587 12.4289 10.0272 18.054 7.01952 numMergedOcc 0
5 mol 34 unq 1 iso 0 dist 9.32818 5.39587 12.4289 6.65242 15.0725 4.58552 numMergedOcc 0
6 mol 39 unq 0 iso 0 dist 9.11806 6.17708 4.01477 4.16606 9.22365 5.27182 numMergedOcc 0
7 mol 39 unq 1 iso 0 dist 9.11806 6.17708 4.01477 5.28487 13.418 9.75289 numMergedOcc 0
8 mol 39 unq 2 iso 0 dist 9.11806 6.17708 4.01477 8.4626 13.0296 9.12545 numMergedOcc 0
9 mol 68 unq 0 iso 0 dist 6.43426 6.72469 6.73987 3.62638 8.8014 5.7369 numMergedOcc 0
10 mol 89 unq 0 iso 0 dist 9.1584 7.02228 4.72096 10.8883 12.6267 8.05579 numMergedOcc 0
11 mol 115 unq 0 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 8.52784 5.05627 7.18009 6.83215 14.3376 7.92216 numMergedOcc 0
13 mol 141 unq 1 iso 0 dist 8.76784 5.05627 6.90735 6.83215 4.54218 7.92216 numMergedOcc 0
14 mol 186 unq 0 iso 0 dist 8.30192 8.9388 5.72704 4.68208 9.68014 8.5672 numMergedOcc 0
15 mol 186 unq 1 iso 0 dist 7.59599 8.95209 5.74741 13.1688 10.8084 8.36129 numMergedOcc 0
16 mol 186 unq 2 iso 0 dist 7.59599 8.95209 5.74741 12.4508 9.97846 5.86483 numMergedOcc 0
17 mol 186 unq 3 iso 0 dist 7.76429 8.95209 12.4955 13.1688 15.7838 8.36129 numMergedOcc 0
18 mol 186 unq 4 iso 0 dist 7.76429 8.95209 12.4955 12.4508 14.4993 5.86483 numMergedOcc 0
19 mol 186 unq 5 iso 0 dist 7.73733 8.95209 14.6855 13.1688 19.9697 8.36129 numMergedOcc 0
20 mol 186 unq 6 iso 0 dist 7.73733 8.95209 14.6855 12.4508 18.6042 5.86483 numMergedOcc 0
21 mol 204 unq 0 iso 0 dist 8.76729 7.59666 9.72425 5.10199 9.93698 9.26214 numMergedOcc 0
22 mol 204 unq 1 iso 0 dist 8.76729 6.51936 7.17392 5.10199 9.93698 5.00369 numMergedOcc 0
23 mol 217 unq 0 iso 0 dist 8.75987 8.28155 8.43469 12.1239 9.75853 9.37602 numMergedOcc 0
24 mol 217 unq 1 iso 0 dist 8.75987 8.28155 8.43469 9.1242 13.2115 8.26522 numMergedOcc 0
25 mol 235 unq 0 iso 0 dist 6.69765 6.92276 5.66713 7.00699 9.20504 8.85214 numMergedOcc 0
26 mol 235 unq 1 iso 0 dist 6.69765 6.92276 5.66713 7.69605 6.15704 5.1874 numMergedOcc 0
27 mol 235 unq 2 iso 0 dist 5.99439 8.75776 5.66713 5.08355 9.20504 8.85214 numMergedOcc 0
28 mol 235 unq 3 iso 0 dist 5.99439 8.75776 5.66713 6.1439 6.15704 5.1874 numMergedOcc 0
29 mol 243 unq 0 iso 0 dist 8.10349 9.30388 3.98086 5.76716 8.8602 8.30024 numMergedOcc 0
30 mol 243 unq 1 iso 0 dist 8.10349 8.96099 4.02386 5.76716 8.8602 8.20943 numMergedOcc 0
31 mol 243 unq 2 iso 0 dist 9.62793 9.30388 4.03312 5.76716 7.13476 8.30024 numMergedOcc 0
32 mol 243 unq 3 iso 0 dist 9.62793 8.96099 9.0802 5.76716 7.13476 8.20943 numMergedOcc 0
33 mol 243 unq 4 iso 0 dist 9.98018 9.30388 6.95692 5.76716 12.6562 8.30024 numMergedOcc 0
34 mol 243 unq 5 iso 0 dist 9.98018 8.96099 9.25649 5.76716 12.6562 8.20943 numMergedOcc 0
35 mol 243 unq 6 iso 0 dist 6.33501 6.56525 4.02386 9.67191 8.8602 8.20943 numMergedOcc 0
36 mol 243 unq 7 iso 0 dist 8.46048 6.56525 9.25649 9.67191 12.6562 8.20943 numMergedOcc 0
37 mol 243 unq 8 iso 0 dist 6.67803 6.56525 6.41173 9.67191 9.49016 8.20943 numMergedOcc 0
