0 mol 39 unq 0 iso 0 dist 8.28439 7.14422 7.33969 8.65907 8.19733 11.962 numMergedOcc 0
1 mol 45 unq 0 iso 0 dist 6.94727 5.2876 6.99408 9.16258 7.95778 6.18811 numMergedOcc 0
2 mol 45 unq 1 iso 0 dist 6.94727 5.28153 9.3403 9.16258 7.95778 6.67086 numMergedOcc 0
3 mol 130 unq 0 iso 0 dist 9.03277 5.72266 6.79146 12.6692 6.42785 7.55374 numMergedOcc 0
4 mol 130 unq 1 iso 0 dist 9.03277 5.72266 6.79146 9.65804 6.82089 9.44878 numMergedOcc 0
5 mol 130 unq 2 iso 0 dist 9.03277 5.96312 7.66168 12.6692 6.42785 11.576 numMergedOcc 0
6 mol 130 unq 3 iso 0 dist 9.03277 5.96312 7.66168 9.65804 6.82089 4.28797 numMergedOcc 0
7 mol 130 unq 4 iso 0 dist 9.03277 10.8983 6.89257 12.6692 6.42785 5.97111 numMergedOcc 0
8 mol 130 unq 5 iso 0 dist 9.03277 10.8983 6.89257 9.65804 6.82089 6.97875 numMergedOcc 0
9 mol 133 unq 0 iso 0 dist 8.25207 14.4683 7.92688 11.1685 9.4062 8.6769 numMergedOcc 0
10 mol 147 unq 0 iso 0 dist 5.96285 5.90364 8.33261 9.78167 7.01133 12.6979 numMergedOcc 0
11 mol 173 unq 0 iso 0 dist 9.25763 15.2665 7.93331 10.3324 7.54706 6.65184 numMergedOcc 0
12 mol 173 unq 1 iso 0 dist 9.25763 12.006 6.98095 10.3324 7.54706 4.68119 numMergedOcc 0
13 mol 173 unq 2 iso 0 dist 9.25763 14.7376 8.31897 10.3324 7.54706 6.6407 numMergedOcc 0
14 mol 173 unq 3 iso 0 dist 9.63102 14.1226 7.93331 8.36814 7.54706 6.65184 numMergedOcc 0
15 mol 173 unq 4 iso 0 dist 9.63102 11.6705 6.98095 8.36814 7.54706 4.68119 numMergedOcc 0
16 mol 173 unq 5 iso 0 dist 9.63102 12.3698 8.31897 8.36814 7.54706 6.6407 numMergedOcc 0
17 mol 175 unq 0 iso 0 dist 6.84347 12.1089 9.31887 10.9098 7.01126 13.9336 numMergedOcc 0
18 mol 175 unq 1 iso 0 dist 6.84347 12.1089 9.31887 5.31207 6.58434 11.873 numMergedOcc 0
19 mol 184 unq 0 iso 0 dist 5.59438 9.56234 9.52936 6.78683 6.21206 8.41716 numMergedOcc 0
20 mol 184 unq 1 iso 0 dist 5.59438 6.87845 9.15417 6.78683 6.21206 5.72305 numMergedOcc 0
21 mol 214 unq 0 iso 0 dist 6.35728 10.644 7.46831 5.20422 5.10114 5.63388 numMergedOcc 0
22 mol 214 unq 1 iso 0 dist 6.35728 4.82712 8.60247 5.20422 5.10114 6.214 numMergedOcc 0
23 mol 227 unq 0 iso 0 dist 8.34104 14.9329 8.17891 7.69431 7.1372 10.5813 numMergedOcc 0
24 mol 227 unq 1 iso 0 dist 8.34104 13.2783 6.95902 7.69431 7.1372 7.22396 numMergedOcc 0
25 mol 235 unq 0 iso 0 dist 8.60471 5.47633 9.58736 10.9906 9.31673 15.0089 numMergedOcc 0
26 mol 235 unq 1 iso 0 dist 8.60471 10.2835 9.43058 10.9906 9.31673 11.1908 numMergedOcc 0
27 mol 235 unq 2 iso 0 dist 8.60471 12.4425 8.75735 10.9906 9.31673 7.87789 numMergedOcc 0
28 mol 235 unq 3 iso 0 dist 8.60471 15.2767 6.98084 10.9906 9.31673 11.5211 numMergedOcc 0
29 mol 235 unq 4 iso 0 dist 8.60471 11.9322 7.32211 10.9906 9.31673 6.65703 numMergedOcc 0
30 mol 278 unq 0 iso 0 dist 7.76881 9.40662 6.35287 11.8647 9.48589 6.54009 numMergedOcc 0
31 mol 294 unq 0 iso 0 dist 9.20616 11.0443 9.03492 10.9639 8.32473 5.25615 numMergedOcc 0
