0 mol 21 unq 0 iso 0 dist 8.38921 5.20061 5.93898 10.5369 10.6971 6.28263 numMergedOcc 0
1 mol 25 unq 0 iso 0 dist 6.00307 11.2808 9.48085 10.0899 6.08585 6.53269 numMergedOcc 0
2 mol 25 unq 1 iso 0 dist 6.00307 11.2808 9.48085 14.0727 9.15781 9.81524 numMergedOcc 0
3 mol 58 unq 0 iso 0 dist 9.92438 3.73561 8.66539 10.8203 6.49081 9.02642 numMergedOcc 0
4 mol 58 unq 1 iso 0 dist 7.66055 3.73561 5.38524 10.8203 9.37804 9.02642 numMergedOcc 0
5 mol 60 unq 0 iso 0 dist 8.46609 12.2249 7.57295 16.1537 9.49968 6.63448 numMergedOcc 0
6 mol 76 unq 0 iso 0 dist 7.63534 10.4541 9.85905 9.2958 6.45686 7.46095 numMergedOcc 0
7 mol 76 unq 1 iso 0 dist 8.51543 5.4968 6.72869 11.2779 4.85247 7.46095 numMergedOcc 0
8 mol 79 unq 0 iso 0 dist 7.79726 3.89377 9.76379 6.9297 6.79583 7.43127 numMergedOcc 0
9 mol 112 unq 0 iso 0 dist 6.5258 4.03471 4.22363 9.67842 4.35926 8.06134 numMergedOcc 0
10 mol 112 unq 1 iso 0 dist 6.5258 4.03471 4.22363 5.93497 5.76098 5.36587 numMergedOcc 0
11 mol 134 unq 0 iso 0 dist 8.75736 14.0091 9.00918 15.5174 14.2198 7.83568 numMergedOcc 0
12 mol 134 unq 1 iso 0 dist 6.76166 9.88169 9.00918 12.8792 14.2198 7.83568 numMergedOcc 0
13 mol 186 unq 0 iso 0 dist 8.16369 14.8867 8.73533 15.1522 7.30024 9.45907 numMergedOcc 0
14 mol 186 unq 1 iso 0 dist 7.09426 12.6481 7.2793 16.2643 10.5063 6.88127 numMergedOcc 0
15 mol 204 unq 0 iso 0 dist 6.20646 6.05253 7.9133 10.6991 5.86489 9.48625 numMergedOcc 0
16 mol 204 unq 1 iso 0 dist 6.73266 13.3588 7.9133 9.639 5.86489 9.48625 numMergedOcc 0
17 mol 234 unq 0 iso 0 dist 8.9413 14.075 7.81215 12.7701 10.0059 7.77911 numMergedOcc 0
18 mol 234 unq 1 iso 0 dist 4.91961 4.84686 7.81215 9.33455 10.0059 7.77911 numMergedOcc 0
19 mol 234 unq 2 iso 0 dist 7.14333 4.84686 5.64285 9.33455 5.08515 7.77911 numMergedOcc 0
20 mol 235 unq 0 iso 0 dist 8.79626 9.92254 5.1823 14.0786 6.46722 8.97952 numMergedOcc 0
21 mol 239 unq 0 iso 0 dist 6.92721 3.45727 6.73665 9.26512 11.169 8.95511 numMergedOcc 0
22 mol 239 unq 1 iso 0 dist 6.92721 3.45727 6.73665 5.82804 5.88931 5.85002 numMergedOcc 0
23 mol 267 unq 0 iso 0 dist 6.19138 6.43871 7.34981 6.55433 8.37094 6.27154 numMergedOcc 0
24 mol 267 unq 1 iso 0 dist 6.54381 5.40798 7.34981 9.29405 8.37094 6.27154 numMergedOcc 0
25 mol 277 unq 0 iso 0 dist 9.64889 15.23 8.9682 9.7625 7.70529 9.26157 numMergedOcc 0
26 mol 277 unq 1 iso 0 dist 6.70123 15.3157 9.57499 11.2514 6.28695 9.26157 numMergedOcc 0
