0 mol 17 unq 0 iso 0 dist 9.26685 9.78918 14.8435 6.80314 14.487 7.31113 numMergedOcc 0
1 mol 17 unq 0 iso 1 dist 9.26685 6.80314 14.487 9.78918 14.8435 7.31113 numMergedOcc 0
2 mol 48 unq 0 iso 0 dist 6.04551 6.8073 6.62574 5.60663 9.48836 9.17835 numMergedOcc 0
3 mol 48 unq 0 iso 1 dist 6.04551 5.60663 9.48836 6.8073 6.62574 9.17835 numMergedOcc 0
4 mol 48 unq 1 iso 0 dist 6.31161 6.8073 12.2137 5.60663 5.2902 9.17835 numMergedOcc 0
5 mol 48 unq 1 iso 1 dist 6.31161 5.60663 5.2902 6.8073 12.2137 9.17835 numMergedOcc 0
6 mol 79 unq 0 iso 0 dist 7.41952 7.99438 9.30887 6.64915 11.3722 4.44577 numMergedOcc 0
7 mol 79 unq 0 iso 1 dist 7.41952 6.64915 11.3722 7.99438 9.30887 4.44577 numMergedOcc 0
8 mol 92 unq 0 iso 0 dist 7.12199 5.74593 7.27534 8.02376 9.23369 6.3583 numMergedOcc 0
9 mol 92 unq 0 iso 1 dist 7.12199 8.02376 9.23369 5.74593 7.27534 6.3583 numMergedOcc 0
10 mol 92 unq 1 iso 0 dist 7.90837 5.74593 9.58876 8.02376 5.64135 6.3583 numMergedOcc 0
11 mol 92 unq 1 iso 1 dist 7.90837 8.02376 5.64135 5.74593 9.58876 6.3583 numMergedOcc 0
12 mol 92 unq 2 iso 0 dist 9.56884 6.15654 7.21296 7.89887 9.18931 6.36037 numMergedOcc 0
13 mol 92 unq 2 iso 1 dist 9.56884 7.89887 9.18931 6.15654 7.21296 6.36037 numMergedOcc 0
14 mol 92 unq 3 iso 0 dist 8.67865 6.15654 9.52463 7.89887 6.07224 6.36037 numMergedOcc 0
15 mol 92 unq 3 iso 1 dist 8.67865 7.89887 6.07224 6.15654 9.52463 6.36037 numMergedOcc 0
16 mol 92 unq 4 iso 0 dist 8.40148 6.15654 9.30089 7.89887 5.77554 6.36037 numMergedOcc 0
17 mol 92 unq 4 iso 1 dist 8.40148 7.89887 5.77554 6.15654 9.30089 6.36037 numMergedOcc 0
18 mol 120 unq 0 iso 0 dist 9.18835 5.12002 10.1606 8.46914 5.30162 6.60099 numMergedOcc 0
19 mol 120 unq 0 iso 1 dist 9.18835 8.46914 5.30162 5.12002 10.1606 6.60099 numMergedOcc 0
20 mol 129 unq 0 iso 0 dist 8.34427 7.32407 4.68204 6.48695 9.09658 5.41583 numMergedOcc 0
21 mol 129 unq 0 iso 1 dist 8.34427 6.48695 9.09658 7.32407 4.68204 5.41583 numMergedOcc 0
22 mol 171 unq 0 iso 0 dist 9.47945 6.4751 15.864 5.75085 14.3848 3.98338 numMergedOcc 0
23 mol 171 unq 0 iso 1 dist 9.47945 5.75085 14.3848 6.4751 15.864 3.98338 numMergedOcc 0
24 mol 197 unq 0 iso 0 dist 8.51118 9.87211 4.91904 6.3997 7.59634 5.33623 numMergedOcc 0
25 mol 197 unq 0 iso 1 dist 8.51118 6.3997 7.59634 9.87211 4.91904 5.33623 numMergedOcc 0
26 mol 197 unq 1 iso 0 dist 6.5 9.87211 6.79468 6.3997 5.31205 5.33623 numMergedOcc 0
27 mol 197 unq 1 iso 1 dist 6.5 6.3997 5.31205 9.87211 6.79468 5.33623 numMergedOcc 0
28 mol 236 unq 0 iso 0 dist 7.6402 8.88405 8.43621 7.13854 6.96377 6.06161 numMergedOcc 0
29 mol 236 unq 0 iso 1 dist 7.6402 7.13854 6.96377 8.88405 8.43621 6.06161 numMergedOcc 0
30 mol 239 unq 0 iso 0 dist 8.34832 6.91534 15.1473 8.67704 16.5164 5.55889 numMergedOcc 0
31 mol 239 unq 0 iso 1 dist 8.34832 8.67704 16.5164 6.91534 15.1473 5.55889 numMergedOcc 0
