0 mol 7 unq 0 iso 0 dist 9.8603 16.6461 9.67164 20.3971 12.2041 5.99459 20.1827 10.515 8.81608 6.06176 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 5.51421 4.7739 5.99459 13.5184 12.2041 9.67164 10.9688 6.06176 8.81608 10.515 numMergedOcc 0
2 mol 25 unq 0 iso 0 dist 8.40051 13.591 9.48085 8.6396 10.9391 9.49421 12.5693 12.1492 8.53931 4.70708 numMergedOcc 0
3 mol 25 unq 1 iso 0 dist 8.6396 13.591 9.49421 8.40051 10.9391 9.48085 12.5693 4.70708 8.53931 12.1492 numMergedOcc 0
4 mol 62 unq 0 iso 0 dist 8.1599 5.46563 6.9103 14.3699 8.62608 9.69044 8.84323 5.49555 9.1062 11.7069 numMergedOcc 0
5 mol 78 unq 0 iso 0 dist 9.10981 9.89481 8.65848 13.9943 7.19663 6.85523 10.1762 5.22036 5.47706 4.92509 numMergedOcc 0
6 mol 78 unq 1 iso 0 dist 9.23023 13.8703 6.85523 13.6324 7.19663 8.65848 13.8574 4.92509 5.47706 5.22036 numMergedOcc 0
7 mol 115 unq 0 iso 0 dist 5.02717 12.6105 9.42082 12.5189 7.69052 6.39384 13.1716 10.9739 8.0168 10.7942 numMergedOcc 0
8 mol 119 unq 0 iso 0 dist 6.18763 5.92411 8.95212 8.44385 10.9871 6.99446 10.2497 10.3457 6.13374 6.35763 numMergedOcc 0
9 mol 119 unq 1 iso 0 dist 6.18763 5.92411 8.95212 8.44385 10.9871 6.99446 13.4009 16.7975 9.08536 7.36192 numMergedOcc 0
10 mol 119 unq 2 iso 0 dist 6.18763 5.92411 8.95212 5.63005 9.93257 7.64052 10.2497 10.3457 6.13374 10.0197 numMergedOcc 0
11 mol 119 unq 3 iso 0 dist 6.18763 5.92411 8.95212 5.63005 9.93257 7.64052 13.4009 16.7975 9.08536 10.6679 numMergedOcc 0
12 mol 119 unq 4 iso 0 dist 8.44385 5.92411 6.99446 6.18763 10.9871 8.95212 10.2497 6.35763 6.13374 10.3457 numMergedOcc 0
13 mol 119 unq 5 iso 0 dist 8.44385 5.92411 6.99446 6.18763 10.9871 8.95212 13.4009 7.36192 9.08536 16.7975 numMergedOcc 0
14 mol 119 unq 6 iso 0 dist 8.44385 5.92411 6.99446 5.63005 4.85907 7.64052 10.2497 6.35763 6.13374 10.0197 numMergedOcc 0
15 mol 119 unq 7 iso 0 dist 8.44385 5.92411 6.99446 5.63005 4.85907 7.64052 13.4009 7.36192 9.08536 10.6679 numMergedOcc 0
16 mol 119 unq 8 iso 0 dist 5.63005 5.92411 7.64052 6.18763 9.93257 8.95212 10.2497 10.0197 6.13374 10.3457 numMergedOcc 0
17 mol 119 unq 9 iso 0 dist 5.63005 5.92411 7.64052 6.18763 9.93257 8.95212 13.4009 10.6679 9.08536 16.7975 numMergedOcc 0
18 mol 119 unq 10 iso 0 dist 5.63005 5.92411 7.64052 8.44385 4.85907 6.99446 10.2497 10.0197 6.13374 6.35763 numMergedOcc 0
19 mol 119 unq 11 iso 0 dist 5.63005 5.92411 7.64052 8.44385 4.85907 6.99446 13.4009 10.6679 9.08536 7.36192 numMergedOcc 0
20 mol 181 unq 0 iso 0 dist 9.84952 9.77747 9.01624 13.0935 11.5866 5.05973 6.17129 6.7991 6.76746 8.35755 numMergedOcc 0
21 mol 181 unq 1 iso 0 dist 7.41378 4.76079 5.05973 10.8641 11.5866 9.01624 5.83596 8.35755 6.76746 6.7991 numMergedOcc 0
22 mol 197 unq 0 iso 0 dist 8.3337 17.2264 9.10817 13.2564 5.43601 6.86828 10.7619 5.2908 9.27218 6.23998 numMergedOcc 0
23 mol 234 unq 0 iso 0 dist 7.86368 9.8663 7.81215 11.8838 10.2693 5.64285 10.0197 5.56749 9.11572 8.0608 numMergedOcc 0
24 mol 234 unq 1 iso 0 dist 7.86368 9.8663 7.81215 11.8838 10.2693 5.64285 17.1531 15.015 9.49229 5.34613 numMergedOcc 0
25 mol 234 unq 2 iso 0 dist 7.86368 9.8663 7.81215 11.8838 10.2693 5.64285 16.337 12.1076 7.20293 6.29366 numMergedOcc 0
26 mol 259 unq 0 iso 0 dist 9.54857 5.49348 5.85442 9.56653 9.98105 6.9899 10.5864 5.79468 6.23661 5.31048 numMergedOcc 0
27 mol 259 unq 1 iso 0 dist 6.42725 6.09466 6.9899 9.73341 9.98105 5.85442 8.65525 5.31048 6.23661 5.79468 numMergedOcc 0
28 mol 267 unq 0 iso 0 dist 9.62043 8.3484 7.34981 14.5482 5.91646 8.8293 11.2069 6.45566 5.08174 7.11419 numMergedOcc 0
29 mol 292 unq 0 iso 0 dist 9.6898 18.4042 9.9182 19.0288 10.3106 7.30758 19.3694 9.98079 9.08193 5.07048 numMergedOcc 0
30 mol 292 unq 1 iso 0 dist 9.6898 18.4042 9.9182 19.0288 10.3106 7.30758 27.0006 18.0293 8.73515 12.1551 numMergedOcc 0
31 mol 292 unq 2 iso 0 dist 9.6898 18.4042 9.9182 20.8961 12.1693 9.10788 19.3694 9.98079 9.08193 10.0311 numMergedOcc 0
32 mol 292 unq 3 iso 0 dist 9.6898 18.4042 9.9182 20.8961 12.1693 9.10788 27.0006 18.0293 8.73515 10.8709 numMergedOcc 0
33 mol 292 unq 4 iso 0 dist 5.75596 6.65781 9.9182 10.9895 10.3106 7.30758 10.7352 9.98079 9.08193 5.07048 numMergedOcc 0
34 mol 292 unq 5 iso 0 dist 5.75596 6.65781 9.9182 10.9895 10.3106 7.30758 14.2121 18.0293 8.73515 12.1551 numMergedOcc 0
35 mol 292 unq 6 iso 0 dist 5.75596 6.65781 9.9182 8.37867 12.1693 9.10788 10.7352 9.98079 9.08193 10.0311 numMergedOcc 0
36 mol 292 unq 7 iso 0 dist 5.75596 6.65781 9.9182 8.37867 12.1693 9.10788 14.2121 18.0293 8.73515 10.8709 numMergedOcc 0
37 mol 292 unq 8 iso 0 dist 8.37867 6.65781 9.10788 5.75596 12.1693 9.9182 10.7352 10.0311 9.08193 9.98079 numMergedOcc 0
38 mol 292 unq 9 iso 0 dist 8.37867 6.65781 9.10788 5.75596 12.1693 9.9182 14.2121 10.8709 8.73515 18.0293 numMergedOcc 0
39 mol 292 unq 10 iso 0 dist 8.37867 6.65781 9.10788 10.9895 12.6861 7.30758 10.7352 10.0311 9.08193 5.07048 numMergedOcc 0
40 mol 292 unq 11 iso 0 dist 8.37867 6.65781 9.10788 10.9895 12.6861 7.30758 14.2121 10.8709 8.73515 12.1551 numMergedOcc 0
