0 mol 24 unq 0 iso 0 dist 6.84355 15.0245 9.33902 9.79529 4.42703 6.80849 numMergedOcc 0
1 mol 54 unq 0 iso 0 dist 6.57773 5.45717 5.76314 10.5402 9.65953 6.13476 numMergedOcc 0
2 mol 91 unq 0 iso 0 dist 8.81788 11.8632 8.17327 13.2479 5.55005 8.00525 numMergedOcc 0
3 mol 91 unq 1 iso 0 dist 7.01323 11.8632 9.52936 13.2479 9.57561 8.00525 numMergedOcc 0
4 mol 91 unq 2 iso 0 dist 7.23655 14.205 8.42914 10.65 7.45926 8.00525 numMergedOcc 0
5 mol 91 unq 3 iso 0 dist 6.26129 14.205 8.17327 10.65 5.55005 8.00525 numMergedOcc 0
6 mol 91 unq 4 iso 0 dist 5.8881 14.205 9.52936 10.65 9.57561 8.00525 numMergedOcc 0
7 mol 110 unq 0 iso 0 dist 7.34054 6.99654 9.32154 10.6355 5.21847 8.93253 numMergedOcc 0
8 mol 110 unq 1 iso 0 dist 7.34054 6.99654 9.32154 7.77678 4.60073 8.1306 numMergedOcc 0
9 mol 132 unq 0 iso 0 dist 8.98223 8.81724 8.78382 16.0734 11.6546 7.84864 numMergedOcc 0
10 mol 186 unq 0 iso 0 dist 7.59599 10.6164 5.52744 16.3342 9.06308 8.84116 numMergedOcc 0
11 mol 186 unq 1 iso 0 dist 7.59599 10.6164 5.52744 18.4942 11.7317 8.16369 numMergedOcc 0
12 mol 186 unq 2 iso 0 dist 7.76429 5.18812 6.23859 6.0639 11.1768 9.71735 numMergedOcc 0
13 mol 186 unq 3 iso 0 dist 7.76429 5.18812 6.23859 6.91355 6.22624 9.04898 numMergedOcc 0
14 mol 186 unq 4 iso 0 dist 7.73733 5.18812 7.50691 6.0639 7.03438 9.71735 numMergedOcc 0
15 mol 186 unq 5 iso 0 dist 7.73733 5.18812 7.50691 6.91355 5.22317 9.04898 numMergedOcc 0
16 mol 204 unq 0 iso 0 dist 8.76729 4.65143 9.06541 9.92686 10.4409 5.5581 numMergedOcc 0
17 mol 238 unq 0 iso 0 dist 7.41211 5.81253 8.39627 9.39537 15.529 8.39522 numMergedOcc 0
18 mol 238 unq 1 iso 0 dist 7.41211 5.81253 8.39627 8.97461 5.37535 5.99187 numMergedOcc 0
19 mol 238 unq 2 iso 0 dist 7.41211 5.81253 8.39627 8.89487 4.14233 9.93378 numMergedOcc 0
20 mol 277 unq 0 iso 0 dist 6.87362 13.3428 9.39009 8.33977 5.07427 6.70123 numMergedOcc 0
21 mol 280 unq 0 iso 0 dist 8.72928 12.5725 9.69573 14.7662 10.3716 7.1704 numMergedOcc 0
22 mol 280 unq 1 iso 0 dist 8.72928 12.5725 9.69573 20.5684 13.86 9.63837 numMergedOcc 0
23 mol 280 unq 2 iso 0 dist 8.72928 9.1916 6.42515 14.7662 10.3716 5.59626 numMergedOcc 0
24 mol 280 unq 3 iso 0 dist 8.32734 4.46069 9.69573 10.7274 10.3716 7.1704 numMergedOcc 0
25 mol 280 unq 4 iso 0 dist 8.32734 4.46069 9.69573 12.1763 13.86 9.63837 numMergedOcc 0
26 mol 280 unq 5 iso 0 dist 8.32734 8.05755 6.42515 10.7274 10.3716 5.59626 numMergedOcc 0
27 mol 280 unq 6 iso 0 dist 9.68942 9.1916 9.8581 14.7662 13.8682 5.59626 numMergedOcc 0
