0 mol 37 unq 0 iso 0 dist 8.40835 9.92538 11.4772 3.71371 7.86029 13.0661 4.81503 7.65802 12.6757 4.61408 numMergedOcc 0
1 mol 71 unq 0 iso 0 dist 5.75102 5.70431 6.06105 5.31671 9.3877 11.0171 12.2856 8.92529 14.6705 12.1458 numMergedOcc 0
2 mol 103 unq 0 iso 0 dist 8.70106 9.61913 12.2951 14.2575 8.10965 20.2003 5.40051 8.078 10.8207 12.706 numMergedOcc 0
3 mol 103 unq 1 iso 0 dist 8.70106 9.61913 12.2951 14.2575 8.10965 20.2003 14.0531 6.56481 18.2493 3.9634 numMergedOcc 0
4 mol 158 unq 0 iso 0 dist 6.45502 9.58371 5.97811 10.9769 8.6903 11.9055 13.5755 9.38856 11.6992 4.0331 numMergedOcc 0
5 mol 158 unq 1 iso 0 dist 8.66056 7.13199 5.97811 11.0962 8.6903 11.9055 12.9207 9.38856 11.6992 4.0331 numMergedOcc 0
6 mol 165 unq 0 iso 0 dist 3.87901 8.67001 7.1886 6.29065 8.19939 10.6242 8.4352 7.21397 11.8119 7.20315 numMergedOcc 0
7 mol 167 unq 0 iso 0 dist 6.6514 7.93807 7.33075 6.25478 7.04009 9.83216 8.3419 7.20545 12.98 4.91302 numMergedOcc 0
8 mol 189 unq 0 iso 0 dist 9.20296 7.45329 12.7664 10.9007 9.40683 17.7292 8.18227 6.38294 14.4543 6.55569 numMergedOcc 0
9 mol 287 unq 0 iso 0 dist 9.11602 8.82948 15.3271 9.45859 7.64715 17.7995 7.31462 8.40726 16.1408 4.23467 numMergedOcc 0
10 mol 287 unq 1 iso 0 dist 9.11602 8.82948 15.3271 9.45859 7.64715 17.7995 6.64598 5.15923 13.2992 5.71189 numMergedOcc 0
11 mol 287 unq 2 iso 0 dist 9.11602 8.82948 15.3271 14.2612 8.50508 21.3002 7.31462 8.40726 16.1408 10.478 numMergedOcc 0
12 mol 287 unq 3 iso 0 dist 9.11602 8.82948 15.3271 14.2612 8.50508 21.3002 6.64598 5.15923 13.2992 8.049 numMergedOcc 0
13 mol 288 unq 0 iso 0 dist 9.11602 8.82948 15.3271 9.45859 7.64715 17.7995 7.31462 8.40726 16.1408 4.23467 numMergedOcc 0
14 mol 288 unq 1 iso 0 dist 9.11602 8.82948 15.3271 9.45859 7.64715 17.7995 6.64598 5.15923 13.2992 5.71189 numMergedOcc 0
15 mol 288 unq 2 iso 0 dist 9.11602 8.82948 15.3271 14.2612 8.50508 21.3002 7.31462 8.40726 16.1408 10.478 numMergedOcc 0
16 mol 288 unq 3 iso 0 dist 9.11602 8.82948 15.3271 14.2612 8.50508 21.3002 6.64598 5.15923 13.2992 8.049 numMergedOcc 0
17 mol 289 unq 0 iso 0 dist 9.11602 8.82948 15.3271 9.45859 7.64715 17.7995 7.31462 8.40726 16.1408 4.23467 numMergedOcc 0
18 mol 289 unq 1 iso 0 dist 9.11602 8.82948 15.3271 9.45859 7.64715 17.7995 6.64598 5.15923 13.2992 5.71189 numMergedOcc 0
19 mol 289 unq 2 iso 0 dist 9.11602 8.82948 15.3271 14.2612 8.50508 21.3002 7.31462 8.40726 16.1408 10.478 numMergedOcc 0
20 mol 289 unq 3 iso 0 dist 9.11602 8.82948 15.3271 14.2612 8.50508 21.3002 6.64598 5.15923 13.2992 8.049 numMergedOcc 0
