0 mol 6 unq 0 iso 0 dist 9.68907 7.74208 12.0033 8.5741 6.30562 12.9421 numMergedOcc 0
1 mol 26 unq 0 iso 0 dist 6.42206 9.08976 6.66387 13.9878 9.70778 10.9263 numMergedOcc 0
2 mol 79 unq 0 iso 0 dist 9.04935 7.93317 9.59811 10.6431 5.69384 12.8658 numMergedOcc 0
3 mol 79 unq 1 iso 0 dist 9.04935 7.11013 11.9573 10.6431 5.69384 13.8091 numMergedOcc 0
4 mol 79 unq 2 iso 0 dist 9.04935 9.62096 13.9374 10.6431 5.69384 15.797 numMergedOcc 0
5 mol 93 unq 0 iso 0 dist 8.84466 5.77804 12.5605 3.74136 8.42713 7.85041 numMergedOcc 0
6 mol 93 unq 1 iso 0 dist 9.2948 5.77804 10.878 3.74136 8.21032 7.85041 numMergedOcc 0
7 mol 128 unq 0 iso 0 dist 8.54297 8.04178 10.7037 5.34549 9.85832 9.89462 numMergedOcc 0
8 mol 128 unq 1 iso 0 dist 9.35162 8.04178 8.80709 11.0542 6.4416 11.7916 numMergedOcc 0
9 mol 128 unq 2 iso 0 dist 9.35162 8.04178 8.80709 5.34549 7.49024 9.89462 numMergedOcc 0
10 mol 130 unq 0 iso 0 dist 8.87505 9.02079 4.72188 14.0139 7.39532 10.3718 numMergedOcc 0
11 mol 130 unq 1 iso 0 dist 8.87505 9.02079 4.72188 4.91324 6.62468 5.38314 numMergedOcc 0
12 mol 147 unq 0 iso 0 dist 5.70772 7.9061 4.10092 5.78019 6.4752 5.1101 numMergedOcc 0
13 mol 147 unq 1 iso 0 dist 5.70772 4.48898 4.47436 5.78019 6.4752 7.01133 numMergedOcc 0
14 mol 147 unq 2 iso 0 dist 5.03663 6.36426 4.10092 4.52246 6.4752 5.1101 numMergedOcc 0
15 mol 147 unq 3 iso 0 dist 5.03663 7.06711 4.47436 4.52246 6.4752 7.01133 numMergedOcc 0
16 mol 147 unq 4 iso 0 dist 8.93916 7.6489 4.10092 5.88056 6.4752 5.1101 numMergedOcc 0
17 mol 181 unq 0 iso 0 dist 8.94464 7.82604 6.39513 5.80934 9.91705 12.1668 numMergedOcc 0
18 mol 181 unq 1 iso 0 dist 8.94464 8.22583 6.24616 5.80934 9.91705 5.49808 numMergedOcc 0
19 mol 181 unq 2 iso 0 dist 8.92685 6.62037 5.56759 5.27973 7.92476 5.49808 numMergedOcc 0
20 mol 181 unq 3 iso 0 dist 8.92685 6.21461 4.43465 5.27973 7.92476 7.96291 numMergedOcc 0
21 mol 226 unq 0 iso 0 dist 7.9801 6.86439 9.92842 5.03475 7.59273 10.0069 numMergedOcc 0
22 mol 226 unq 1 iso 0 dist 6.17825 6.86439 6.25647 5.03475 6.62391 10.0069 numMergedOcc 0
23 mol 266 unq 0 iso 0 dist 6.86805 6.41474 10.0609 5.81384 9.39659 12.1265 numMergedOcc 0
24 mol 266 unq 1 iso 0 dist 6.86805 6.41474 10.0609 7.90451 8.25445 14.1049 numMergedOcc 0
