0 mol 70 unq 0 iso 0 dist 7.95122 10.7301 8.33704 9.74268 5.22626 7.92394 14.243 12.2091 14.4842 7.63663 numMergedOcc 0
1 mol 76 unq 0 iso 0 dist 8.28737 12.2209 8.19682 15.3483 10.2879 6.21982 13.6156 5.56964 7.5192 8.41567 numMergedOcc 0
2 mol 76 unq 1 iso 0 dist 8.28737 12.2209 8.19682 15.3483 10.2879 6.21982 19.999 12.885 9.82998 6.62246 numMergedOcc 0
3 mol 119 unq 0 iso 0 dist 8.32004 7.01214 7.44174 15.0885 12.4603 9.63176 14.6426 16.6272 10.06 8.88255 numMergedOcc 0
4 mol 131 unq 0 iso 0 dist 9.69757 12.4356 8.6243 12.5659 6.63273 6.91348 17.8419 15.0798 9.45501 8.99949 numMergedOcc 0
5 mol 134 unq 0 iso 0 dist 6.99089 15.1358 8.6355 11.6481 5.00817 5.42582 9.32667 5.57904 7.26771 7.27598 numMergedOcc 0
6 mol 155 unq 0 iso 0 dist 8.14907 7.79621 7.39644 14.8578 10.7616 7.36102 14.1477 13.3396 6.79302 5.68636 numMergedOcc 0
7 mol 156 unq 0 iso 0 dist 7.39961 5.58352 8.47155 7.80643 5.76755 9.36805 11.1371 14.1844 11.9162 9.19499 numMergedOcc 0
8 mol 156 unq 1 iso 0 dist 7.39961 5.58352 8.47155 10.8849 7.60354 7.55203 8.64309 11.4132 4.71629 7.98018 numMergedOcc 0
9 mol 156 unq 2 iso 0 dist 7.80643 5.58352 9.36805 10.8849 8.38403 7.55203 8.64309 10.0213 4.71629 7.98018 numMergedOcc 0
10 mol 218 unq 0 iso 0 dist 5.52981 6.48676 7.17547 6.22077 7.83217 7.13323 4.44409 9.82905 7.85937 8.2088 numMergedOcc 0
11 mol 238 unq 0 iso 0 dist 7.2527 14.0776 9.90142 10.3304 5.40359 5.9216 11.2481 5.67917 10.761 8.96639 numMergedOcc 0
12 mol 238 unq 1 iso 0 dist 7.13194 14.751 9.29858 10.3304 10.1648 9.68513 11.2481 12.6253 12.8735 8.96639 numMergedOcc 0
13 mol 238 unq 2 iso 0 dist 9.29203 11.091 9.90142 7.62771 5.40359 5.9216 14.3786 5.67917 10.761 8.96639 numMergedOcc 0
14 mol 238 unq 3 iso 0 dist 7.62771 11.091 5.9216 9.29203 5.40359 9.90142 14.3786 8.96639 10.761 5.67917 numMergedOcc 0
15 mol 238 unq 4 iso 0 dist 7.80166 12.4266 9.29858 7.62771 10.1648 9.68513 14.3786 12.6253 12.8735 8.96639 numMergedOcc 0
16 mol 249 unq 0 iso 0 dist 6.42827 5.63238 8.83735 6.93507 8.34718 8.96876 5.35689 11.455 6.94174 7.72708 numMergedOcc 0
17 mol 272 unq 0 iso 0 dist 7.22438 6.68919 6.73206 7.66615 5.40809 9.09992 13.1178 12.3168 13.7563 7.31993 numMergedOcc 0
