0 mol 8 unq 0 iso 0 dist 8.80278 9.74854 11.4319 8.37509 4.43686 7.85915 numMergedOcc 0
1 mol 8 unq 1 iso 0 dist 8.73998 9.74854 12.6097 8.37509 15.5539 7.85915 numMergedOcc 0
2 mol 14 unq 0 iso 0 dist 6.11408 4.76499 6.96046 5.35021 5.16461 6.59582 numMergedOcc 0
3 mol 61 unq 0 iso 0 dist 5.97418 8.06956 9.42807 8.46207 6.29462 5.07863 numMergedOcc 0
4 mol 62 unq 0 iso 0 dist 7.30392 5.86234 8.89127 9.11976 14.7238 6.49762 numMergedOcc 0
5 mol 66 unq 0 iso 0 dist 7.1612 8.2753 14.9191 7.48714 11.0946 7.08516 numMergedOcc 0
6 mol 67 unq 0 iso 0 dist 6.57749 5.45733 9.08666 4.52009 7.28199 5.21788 numMergedOcc 0
7 mol 69 unq 0 iso 0 dist 7.33546 7.33408 10.5803 9.01561 14.0643 5.69202 numMergedOcc 0
8 mol 69 unq 1 iso 0 dist 7.33546 7.92149 11.6395 9.01561 14.0643 6.18673 numMergedOcc 0
9 mol 114 unq 0 iso 0 dist 9.15982 4.97091 9.53071 9.03707 4.45081 7.08407 numMergedOcc 0
10 mol 136 unq 0 iso 0 dist 8.06032 7.79731 11.3247 8.75073 15.2729 7.94574 numMergedOcc 0
11 mol 148 unq 0 iso 0 dist 8.80448 6.18528 4.37697 7.76167 8.44462 9.75787 numMergedOcc 0
12 mol 148 unq 1 iso 0 dist 8.80448 6.18528 4.37697 8.63766 7.06829 7.53325 numMergedOcc 0
13 mol 148 unq 2 iso 0 dist 8.80448 6.18528 4.37697 8.42082 13.2635 13.1578 numMergedOcc 0
14 mol 150 unq 0 iso 0 dist 8.78855 6.13554 4.33881 7.83202 8.51103 9.78599 numMergedOcc 0
15 mol 150 unq 1 iso 0 dist 8.78855 6.13554 4.33881 8.7107 7.13108 7.68304 numMergedOcc 0
16 mol 150 unq 2 iso 0 dist 8.78855 6.13554 4.33881 8.47493 13.2655 13.1208 numMergedOcc 0
17 mol 174 unq 0 iso 0 dist 5.11555 9.68098 7.64386 7.66734 5.07406 12.3305 numMergedOcc 0
18 mol 178 unq 0 iso 0 dist 7.33326 6.07118 10.2547 8.65373 10.3834 4.94162 numMergedOcc 0
19 mol 178 unq 1 iso 0 dist 7.33326 6.07118 10.2547 8.6561 6.29739 7.4505 numMergedOcc 0
20 mol 178 unq 2 iso 0 dist 7.33326 6.07118 10.2547 9.1197 4.95286 13.5754 numMergedOcc 0
21 mol 192 unq 0 iso 0 dist 5.99974 5.37285 9.37081 7.00749 8.15721 5.61141 numMergedOcc 0
22 mol 211 unq 0 iso 0 dist 5.02094 8.28291 7.77659 6.32818 7.02917 4.95069 numMergedOcc 0
23 mol 220 unq 0 iso 0 dist 7.42784 7.19185 7.58989 9.99489 9.54701 12.8687 numMergedOcc 0
24 mol 220 unq 1 iso 0 dist 6.11123 7.82527 4.80815 7.78448 9.54701 10.2605 numMergedOcc 0
25 mol 220 unq 2 iso 0 dist 7.66083 8.95183 8.17619 9.81907 12.2375 6.39826 numMergedOcc 0
26 mol 250 unq 0 iso 0 dist 9.73318 6.28288 11.6337 8.95513 11.7643 5.0051 numMergedOcc 0
27 mol 250 unq 1 iso 0 dist 5.75551 6.28288 5.95822 8.95513 5.64152 5.0051 numMergedOcc 0
28 mol 260 unq 0 iso 0 dist 9.94532 8.63478 13.8778 4.49691 10.2094 5.67835 numMergedOcc 0
29 mol 260 unq 1 iso 0 dist 9.94532 8.08865 10.7074 4.49691 10.2094 5.23733 numMergedOcc 0
