0 mol 26 unq 0 iso 0 dist 8.06929 4.76147 5.69955 9.08976 4.80984 9.16962 numMergedOcc 0
1 mol 26 unq 1 iso 0 dist 8.58514 5.93227 5.69955 13.0219 4.80984 9.16962 numMergedOcc 0
2 mol 33 unq 0 iso 0 dist 8.41282 6.08005 9.63263 8.94949 4.96642 7.00648 numMergedOcc 0
3 mol 58 unq 0 iso 0 dist 8.98939 8.89982 7.27383 13.3753 9.17656 6.46761 numMergedOcc 0
4 mol 58 unq 1 iso 0 dist 8.98939 8.89982 7.27383 16.2535 10.8775 7.58407 numMergedOcc 0
5 mol 85 unq 0 iso 0 dist 8.64047 12.1235 7.1589 13.0291 12.5072 9.47876 numMergedOcc 0
6 mol 92 unq 0 iso 0 dist 8.53164 9.40516 6.49956 9.77579 4.36639 8.36431 numMergedOcc 0
7 mol 100 unq 0 iso 0 dist 9.70095 5.06206 7.12017 12.2876 6.00843 8.72704 numMergedOcc 0
8 mol 141 unq 0 iso 0 dist 8.92412 4.37081 6.69515 11.0806 8.00633 6.93652 numMergedOcc 0
9 mol 141 unq 1 iso 0 dist 6.97579 10.5394 6.69515 7.1093 8.00633 6.93652 numMergedOcc 0
10 mol 156 unq 0 iso 0 dist 6.96911 8.96288 7.73169 16.0134 14.0853 7.36119 numMergedOcc 0
11 mol 178 unq 0 iso 0 dist 8.56251 4.51874 4.92088 12.452 7.07052 8.96511 numMergedOcc 0
12 mol 195 unq 0 iso 0 dist 9.96728 12.7239 7.62942 15.3406 9.08602 8.36117 numMergedOcc 0
13 mol 195 unq 1 iso 0 dist 9.96728 12.7239 7.62942 16.7625 8.18628 6.77578 numMergedOcc 0
14 mol 204 unq 0 iso 0 dist 7.44979 10.4409 8.0144 12.6981 10.3763 9.59333 numMergedOcc 0
15 mol 204 unq 1 iso 0 dist 9.4236 6.10425 8.0144 15.2979 10.3763 9.59333 numMergedOcc 0
16 mol 218 unq 0 iso 0 dist 7.84953 5.09263 5.76954 8.03194 8.21424 8.53199 numMergedOcc 0
17 mol 218 unq 1 iso 0 dist 4.57726 5.09263 6.29511 8.03194 10.1198 8.53199 numMergedOcc 0
18 mol 234 unq 0 iso 0 dist 8.10427 5.44278 8.24186 11.5443 13.0974 6.25105 numMergedOcc 0
19 mol 234 unq 1 iso 0 dist 8.10427 9.25445 7.5366 15.1563 16.5499 9.5707 numMergedOcc 0
20 mol 234 unq 2 iso 0 dist 8.10427 9.25445 7.5366 11.5443 13.0974 7.85175 numMergedOcc 0
21 mol 234 unq 3 iso 0 dist 9.8716 12.2372 9.007 6.553 7.54397 6.16063 numMergedOcc 0
22 mol 238 unq 0 iso 0 dist 8.24118 10.2134 6.66971 13.6646 5.8333 9.90142 numMergedOcc 0
23 mol 238 unq 1 iso 0 dist 8.24118 12.8163 6.4398 12.3291 6.48619 9.68513 numMergedOcc 0
24 mol 238 unq 2 iso 0 dist 8.24118 12.8163 6.4398 13.6646 5.8333 5.9216 numMergedOcc 0
25 mol 238 unq 3 iso 0 dist 8.24118 5.88384 7.32982 12.3291 6.48619 9.29858 numMergedOcc 0
26 mol 266 unq 0 iso 0 dist 7.92391 4.97892 7.71657 6.41474 8.12927 9.02188 numMergedOcc 0
