0 mol 34 unq 0 iso 0 dist 9.18109 5.80438 6.40741 4.49056 9.31366 4.2695 numMergedOcc 0
1 mol 34 unq 0 iso 1 dist 9.18109 4.49056 9.31366 5.80438 6.40741 4.2695 numMergedOcc 0
2 mol 67 unq 0 iso 0 dist 6.23298 7.29309 9.30836 4.31746 6.58279 4.05717 numMergedOcc 0
3 mol 67 unq 0 iso 1 dist 6.23298 4.31746 6.58279 7.29309 9.30836 4.05717 numMergedOcc 0
4 mol 67 unq 1 iso 0 dist 9.85405 7.83316 9.30836 7.58981 6.58279 4.05717 numMergedOcc 0
5 mol 67 unq 1 iso 1 dist 9.85405 7.58981 6.58279 7.83316 9.30836 4.05717 numMergedOcc 0
6 mol 73 unq 0 iso 0 dist 9.87177 4.53047 7.45801 14.8438 5.30477 11.6934 numMergedOcc 0
7 mol 73 unq 0 iso 1 dist 9.87177 14.8438 5.30477 4.53047 7.45801 11.6934 numMergedOcc 0
8 mol 73 unq 1 iso 0 dist 6.70925 7.05537 7.45801 7.25285 5.30477 11.6934 numMergedOcc 0
9 mol 73 unq 1 iso 1 dist 6.70925 7.25285 5.30477 7.05537 7.45801 11.6934 numMergedOcc 0
10 mol 73 unq 2 iso 0 dist 8.95756 11.9468 7.45801 5.90782 5.30477 11.6934 numMergedOcc 0
11 mol 73 unq 2 iso 1 dist 8.95756 5.90782 5.30477 11.9468 7.45801 11.6934 numMergedOcc 0
12 mol 92 unq 0 iso 0 dist 9.93688 11.6798 7.2131 12.656 7.44343 6.34272 numMergedOcc 0
13 mol 92 unq 0 iso 1 dist 9.93688 12.656 7.44343 11.6798 7.2131 6.34272 numMergedOcc 0
14 mol 92 unq 1 iso 0 dist 9.88184 11.0631 7.2131 14.9487 7.44343 6.34272 numMergedOcc 0
15 mol 92 unq 1 iso 1 dist 9.88184 14.9487 7.44343 11.0631 7.2131 6.34272 numMergedOcc 0
16 mol 141 unq 0 iso 0 dist 6.95914 13.2639 7.35385 10.9097 8.35864 6.59975 numMergedOcc 0
17 mol 141 unq 0 iso 1 dist 6.95914 10.9097 8.35864 13.2639 7.35385 6.59975 numMergedOcc 0
18 mol 192 unq 0 iso 0 dist 7.252 10.02 8.96522 7.02086 7.04366 6.93708 numMergedOcc 0
19 mol 192 unq 0 iso 1 dist 7.252 7.02086 7.04366 10.02 8.96522 6.93708 numMergedOcc 0
20 mol 192 unq 1 iso 0 dist 7.252 10.02 8.96522 11.153 9.99783 16.2658 numMergedOcc 0
21 mol 192 unq 1 iso 1 dist 7.252 11.153 9.99783 10.02 8.96522 16.2658 numMergedOcc 0
22 mol 192 unq 1 iso 0 dist 7.252 7.02086 7.04366 11.153 9.99783 9.92978 numMergedOcc 0
23 mol 192 unq 1 iso 1 dist 7.252 11.153 9.99783 7.02086 7.04366 9.92978 numMergedOcc 0
24 mol 217 unq 0 iso 0 dist 5.89788 7.32888 9.37899 10.7793 6.14304 10.0971 numMergedOcc 0
25 mol 217 unq 0 iso 1 dist 5.89788 10.7793 6.14304 7.32888 9.37899 10.0971 numMergedOcc 0
26 mol 227 unq 0 iso 0 dist 6.14732 4.21811 8.61546 11.032 7.17024 10.7525 numMergedOcc 0
27 mol 227 unq 0 iso 1 dist 6.14732 11.032 7.17024 4.21811 8.61546 10.7525 numMergedOcc 0
28 mol 232 unq 0 iso 0 dist 6.11539 9.74489 6.67239 6.70882 6.23146 5.77703 numMergedOcc 0
29 mol 232 unq 0 iso 1 dist 6.11539 6.70882 6.23146 9.74489 6.67239 5.77703 numMergedOcc 0
30 mol 232 unq 1 iso 0 dist 9.71082 16.2642 6.67239 14.3107 6.23146 5.77703 numMergedOcc 0
31 mol 232 unq 1 iso 1 dist 9.71082 14.3107 6.23146 16.2642 6.67239 5.77703 numMergedOcc 0
32 mol 235 unq 0 iso 0 dist 8.88613 4.32578 6.86251 13.1619 6.20377 10.2834 numMergedOcc 0
33 mol 235 unq 0 iso 1 dist 8.88613 13.1619 6.20377 4.32578 6.86251 10.2834 numMergedOcc 0
34 mol 279 unq 0 iso 0 dist 4.75866 4.34346 6.12347 11.8793 8.79637 9.31504 numMergedOcc 0
35 mol 279 unq 0 iso 1 dist 4.75866 11.8793 8.79637 4.34346 6.12347 9.31504 numMergedOcc 0
36 mol 279 unq 1 iso 0 dist 7.87072 6.68035 6.12347 4.47851 8.79637 9.31504 numMergedOcc 0
37 mol 279 unq 1 iso 1 dist 7.87072 4.47851 8.79637 6.68035 6.12347 9.31504 numMergedOcc 0
