0 mol 10 unq 0 iso 0 dist 8.33546 6.74091 4.17235 8.30413 13.4187 13.9866 numMergedOcc 0
1 mol 63 unq 0 iso 0 dist 9.22609 9.3844 6.6928 7.76666 12.0171 9.29757 numMergedOcc 0
2 mol 85 unq 0 iso 0 dist 7.52742 9.66549 13.8964 8.64047 14.8764 4.39271 numMergedOcc 0
3 mol 93 unq 0 iso 0 dist 5.27541 8.84466 8.74935 8.21739 8.69953 8.02579 numMergedOcc 0
4 mol 93 unq 1 iso 0 dist 5.27541 8.84466 8.74935 4.78377 8.48621 12.3147 numMergedOcc 0
5 mol 93 unq 2 iso 0 dist 5.27541 9.2948 13.5058 8.21739 8.69953 12.1011 numMergedOcc 0
6 mol 93 unq 3 iso 0 dist 5.27541 9.2948 13.5058 4.78377 8.48621 9.97789 numMergedOcc 0
7 mol 104 unq 0 iso 0 dist 9.71834 7.45407 5.23957 6.07166 11.8718 7.13246 numMergedOcc 0
8 mol 108 unq 0 iso 0 dist 9.81705 8.89997 9.35984 9.98276 6.87606 14.1381 numMergedOcc 0
9 mol 108 unq 1 iso 0 dist 9.81705 8.89997 9.35984 8.0671 8.87911 9.46026 numMergedOcc 0
10 mol 108 unq 2 iso 0 dist 6.32309 8.89997 11.9597 9.98276 9.85061 14.1381 numMergedOcc 0
11 mol 108 unq 3 iso 0 dist 6.32309 8.89997 11.9597 8.0671 4.80777 9.46026 numMergedOcc 0
12 mol 108 unq 4 iso 0 dist 8.60437 8.89997 13.7036 9.98276 6.69989 14.1381 numMergedOcc 0
13 mol 108 unq 5 iso 0 dist 8.60437 8.89997 13.7036 8.0671 7.57371 9.46026 numMergedOcc 0
14 mol 108 unq 6 iso 0 dist 5.8711 8.69068 4.85222 6.72426 6.01373 10.5684 numMergedOcc 0
15 mol 109 unq 0 iso 0 dist 9.45085 4.87856 6.71387 6.20301 9.50627 3.95956 numMergedOcc 0
16 mol 120 unq 0 iso 0 dist 9.61273 9.31927 8.50035 7.03509 5.73872 8.92383 numMergedOcc 0
17 mol 124 unq 0 iso 0 dist 7.24083 8.48985 3.89739 9.11203 5.77455 5.46092 numMergedOcc 0
18 mol 124 unq 1 iso 0 dist 7.24083 8.48985 3.89739 5.49109 6.60073 5.02355 numMergedOcc 0
19 mol 186 unq 0 iso 0 dist 5.52744 7.45384 8.66215 8.78339 5.98491 6.10865 numMergedOcc 0
20 mol 186 unq 1 iso 0 dist 6.23859 4.85577 4.12397 9.18314 10.2999 9.52773 numMergedOcc 0
21 mol 287 unq 0 iso 0 dist 5.06731 8.19213 4.22529 6.69569 9.46764 10.8341 numMergedOcc 0
22 mol 287 unq 1 iso 0 dist 5.06731 5.80664 8.19487 6.69569 9.46764 5.80218 numMergedOcc 0
23 mol 288 unq 0 iso 0 dist 5.06731 8.19213 4.22529 6.69569 9.46764 10.8341 numMergedOcc 0
24 mol 288 unq 1 iso 0 dist 5.06731 5.80664 8.19487 6.69569 9.46764 5.80218 numMergedOcc 0
25 mol 289 unq 0 iso 0 dist 5.06731 8.19213 4.22529 6.69569 9.46764 10.8341 numMergedOcc 0
26 mol 289 unq 1 iso 0 dist 5.06731 5.80664 8.19487 6.69569 9.46764 5.80218 numMergedOcc 0
