0 mol 1 unq 0 iso 0 dist 8.61411 9.44115 5.972 5.21705 7.68226 5.96833 numMergedOcc 0
1 mol 10 unq 0 iso 0 dist 7.99404 8.95503 5.30796 6.23648 9.06457 6.02154 numMergedOcc 0
2 mol 59 unq 0 iso 0 dist 6.34078 6.94351 5.29167 10.8454 12.2762 8.67634 numMergedOcc 0
3 mol 67 unq 0 iso 0 dist 6.23298 5.70192 5.52457 3.77705 9.06101 8.96498 numMergedOcc 0
4 mol 67 unq 1 iso 0 dist 6.23298 5.70192 5.52457 11.7466 10.7012 7.5228 numMergedOcc 0
5 mol 67 unq 2 iso 0 dist 9.85405 7.65646 5.52457 7.64337 9.06101 8.96498 numMergedOcc 0
6 mol 67 unq 3 iso 0 dist 9.85405 7.65646 5.52457 10.1845 10.7012 7.5228 numMergedOcc 0
7 mol 88 unq 0 iso 0 dist 9.47957 6.98838 5.71776 7.32542 9.07681 5.28732 numMergedOcc 0
8 mol 88 unq 1 iso 0 dist 9.4046 6.98838 6.64721 7.32542 5.9443 5.28732 numMergedOcc 0
9 mol 98 unq 0 iso 0 dist 6.69328 8.46477 5.34199 3.79201 6.7188 5.81771 numMergedOcc 0
10 mol 119 unq 0 iso 0 dist 5.28955 9.47892 8.00732 13.9667 13.4572 6.55202 numMergedOcc 0
11 mol 119 unq 1 iso 0 dist 5.28955 9.47892 8.00732 15.453 14.5647 9.08536 numMergedOcc 0
12 mol 133 unq 0 iso 0 dist 9.63488 6.73897 9.84339 3.75291 13.276 8.50705 numMergedOcc 0
13 mol 143 unq 0 iso 0 dist 5.46716 9.9492 6.50232 15.3503 13.1485 7.05845 numMergedOcc 0
14 mol 148 unq 0 iso 0 dist 6.60739 8.07915 6.94302 5.4632 10.1739 8.42899 numMergedOcc 0
15 mol 148 unq 1 iso 0 dist 9.22427 8.07915 12.3565 5.4632 14.5709 8.42899 numMergedOcc 0
16 mol 148 unq 2 iso 0 dist 5.55129 8.07915 5.58057 5.4632 5.20262 8.42899 numMergedOcc 0
17 mol 150 unq 0 iso 0 dist 6.71763 7.97801 6.83379 5.36078 10.1489 8.33721 numMergedOcc 0
18 mol 150 unq 1 iso 0 dist 9.32504 7.97801 12.2713 5.36078 14.561 8.33721 numMergedOcc 0
19 mol 150 unq 2 iso 0 dist 5.53778 7.97801 5.55906 5.36078 5.21792 8.33721 numMergedOcc 0
20 mol 197 unq 0 iso 0 dist 6.50727 8.32685 5.92782 15.7632 10.2469 9.27218 numMergedOcc 0
21 mol 197 unq 1 iso 0 dist 7.84826 6.74777 5.92782 15.6628 10.2469 9.27218 numMergedOcc 0
22 mol 197 unq 2 iso 0 dist 7.56537 9.62514 10.1284 18.7224 17.3813 9.27218 numMergedOcc 0
23 mol 197 unq 3 iso 0 dist 9.89975 9.62514 16.3081 18.7224 23.6984 9.27218 numMergedOcc 0
24 mol 234 unq 0 iso 0 dist 8.38742 7.19662 4.69096 5.99784 7.87591 6.86569 numMergedOcc 0
25 mol 238 unq 0 iso 0 dist 9.46728 9.46582 6.23871 5.17342 8.28643 7.39547 numMergedOcc 0
26 mol 239 unq 0 iso 0 dist 8.68803 5.66792 7.4709 11.2891 16.9023 9.74902 numMergedOcc 0
27 mol 243 unq 0 iso 0 dist 8.28364 7.77265 6.88405 8.61196 9.71196 9.33476 numMergedOcc 0
28 mol 245 unq 0 iso 0 dist 6.58637 8.48687 5.77932 10.5397 10.2391 9.43713 numMergedOcc 0
29 mol 245 unq 1 iso 0 dist 5.48167 8.48687 4.45879 10.5397 11.1968 9.43713 numMergedOcc 0
30 mol 273 unq 0 iso 0 dist 9.52454 9.79283 6.32601 12.2057 14.454 9.35749 numMergedOcc 0
