0 mol 10 unq 0 iso 0 dist 6.02543 9.61828 6.18431 9.73087 7.06787 9.07726 numMergedOcc 0
1 mol 24 unq 0 iso 0 dist 8.24948 6.99746 5.80953 13.0098 10.7501 6.61696 numMergedOcc 0
2 mol 24 unq 1 iso 0 dist 6.01284 4.82556 5.78532 14.5223 13.2892 9.73647 numMergedOcc 0
3 mol 24 unq 2 iso 0 dist 6.01284 4.82556 5.78532 9.3934 7.46758 7.26334 numMergedOcc 0
4 mol 24 unq 3 iso 0 dist 6.01284 6.25108 8.49709 9.3934 7.46758 6.19899 numMergedOcc 0
5 mol 24 unq 4 iso 0 dist 7.96195 9.22115 4.44526 16.22 8.40153 9.33304 numMergedOcc 0
6 mol 24 unq 5 iso 0 dist 7.96195 9.22115 4.44526 11.3572 3.73215 4.5711 numMergedOcc 0
7 mol 39 unq 0 iso 0 dist 7.99016 5.14532 8.20298 6.41793 3.52812 6.13351 numMergedOcc 0
8 mol 39 unq 1 iso 0 dist 6.41793 5.14532 6.13351 7.99016 3.52812 8.20298 numMergedOcc 0
9 mol 79 unq 0 iso 0 dist 8.04168 10.6438 6.5551 13.133 6.48468 9.77084 numMergedOcc 0
10 mol 92 unq 0 iso 0 dist 6.98037 8.67827 6.59716 6.9223 6.02822 6.87506 numMergedOcc 0
11 mol 92 unq 1 iso 0 dist 6.9223 8.67827 6.87506 6.98037 6.02822 6.59716 numMergedOcc 0
12 mol 92 unq 2 iso 0 dist 7.0561 13.0818 6.87506 11.0654 6.02822 6.59716 numMergedOcc 0
13 mol 98 unq 0 iso 0 dist 6.83746 14.6934 9.25444 11.6715 6.70343 9.84703 numMergedOcc 0
14 mol 98 unq 1 iso 0 dist 6.83746 11.4207 8.46823 11.6715 6.70343 4.62494 numMergedOcc 0
15 mol 98 unq 2 iso 0 dist 8.75597 8.02554 9.84703 12.2279 6.70343 9.25444 numMergedOcc 0
16 mol 98 unq 3 iso 0 dist 8.75597 11.2092 4.62494 12.2279 6.70343 8.46823 numMergedOcc 0
17 mol 98 unq 4 iso 0 dist 9.14707 16.2968 9.25444 9.18457 6.70343 9.84703 numMergedOcc 0
18 mol 98 unq 5 iso 0 dist 9.14707 8.26478 8.46823 9.18457 6.70343 4.62494 numMergedOcc 0
19 mol 98 unq 6 iso 0 dist 9.18457 16.2968 9.84703 9.14707 6.70343 9.25444 numMergedOcc 0
20 mol 98 unq 7 iso 0 dist 9.18457 8.26478 4.62494 9.14707 6.70343 8.46823 numMergedOcc 0
21 mol 112 unq 0 iso 0 dist 7.44041 15.0784 8.72725 10.2176 5.11 6.11407 numMergedOcc 0
22 mol 186 unq 0 iso 0 dist 8.31881 6.16503 6.88127 12.2866 8.40937 6.56416 numMergedOcc 0
23 mol 194 unq 0 iso 0 dist 5.53324 5.92931 4.19371 11.4466 6.41254 9.71015 numMergedOcc 0
24 mol 214 unq 0 iso 0 dist 8.21997 4.23527 5.31416 9.29924 5.97842 5.44533 numMergedOcc 0
25 mol 225 unq 0 iso 0 dist 7.8744 8.98957 6.94762 12.6753 11.1622 9.89167 numMergedOcc 0
26 mol 260 unq 0 iso 0 dist 9.50634 7.16782 9.31888 12.7525 14.374 6.75725 numMergedOcc 0
