0 mol 24 unq 0 iso 0 dist 8.13365 10.7829 9.75144 6.09311 7.49157 6.72423 numMergedOcc 0
1 mol 24 unq 1 iso 0 dist 8.13365 10.7829 9.75144 9.56533 7.73794 4.0664 numMergedOcc 0
2 mol 26 unq 0 iso 0 dist 7.34549 7.23551 6.73162 8.82979 7.98005 8.62111 numMergedOcc 0
3 mol 26 unq 1 iso 0 dist 7.34549 7.23551 6.73162 3.63999 8.31381 9.18438 numMergedOcc 0
4 mol 26 unq 2 iso 0 dist 8.09068 4.03252 6.73162 12.3884 7.98005 8.62111 numMergedOcc 0
5 mol 26 unq 3 iso 0 dist 8.09068 4.03252 6.73162 11.7163 8.31381 9.18438 numMergedOcc 0
6 mol 26 unq 4 iso 0 dist 9.72289 8.34836 6.73162 15.7944 7.98005 8.62111 numMergedOcc 0
7 mol 26 unq 5 iso 0 dist 9.72289 8.34836 6.73162 13.5789 8.31381 9.18438 numMergedOcc 0
8 mol 43 unq 0 iso 0 dist 8.47617 10.7814 9.83618 14.2755 9.02471 10.4465 numMergedOcc 0
9 mol 127 unq 0 iso 0 dist 8.09965 9.46933 8.59981 5.12492 5.39356 6.92548 numMergedOcc 0
10 mol 127 unq 1 iso 0 dist 8.09965 9.46933 8.59981 9.6877 9.92746 16.8777 numMergedOcc 0
11 mol 127 unq 2 iso 0 dist 8.09965 6.50291 7.34519 5.12492 5.39356 5.87751 numMergedOcc 0
12 mol 127 unq 3 iso 0 dist 8.09965 6.50291 7.34519 9.6877 9.92746 5.08112 numMergedOcc 0
13 mol 152 unq 0 iso 0 dist 9.0847 12.6562 9.13561 5.0146 9.00072 11.2183 numMergedOcc 0
14 mol 178 unq 0 iso 0 dist 7.14849 8.42124 8.96511 8.84201 4.72821 8.86443 numMergedOcc 0
15 mol 178 unq 1 iso 0 dist 8.63718 8.15374 8.96511 7.09333 4.72821 8.86443 numMergedOcc 0
16 mol 213 unq 0 iso 0 dist 7.22234 10.6066 6.0965 12.1593 8.82761 14.229 numMergedOcc 0
17 mol 213 unq 1 iso 0 dist 7.22234 15.6607 9.59129 12.1593 8.82761 14.9475 numMergedOcc 0
18 mol 213 unq 2 iso 0 dist 5.86501 5.56276 6.0965 12.8419 8.82761 14.229 numMergedOcc 0
19 mol 213 unq 3 iso 0 dist 5.86501 10.1617 9.59129 12.8419 8.82761 14.9475 numMergedOcc 0
20 mol 218 unq 0 iso 0 dist 9.85348 7.64323 8.53199 9.51802 7.84952 6.19774 numMergedOcc 0
21 mol 235 unq 0 iso 0 dist 8.84872 13.4086 9.58736 3.90737 8.08965 14.2299 numMergedOcc 0
22 mol 238 unq 0 iso 0 dist 6.51823 9.28896 6.77463 5.61713 6.46771 12.0336 numMergedOcc 0
23 mol 238 unq 1 iso 0 dist 6.51823 6.04481 7.2766 5.61713 6.46771 3.94343 numMergedOcc 0
24 mol 240 unq 0 iso 0 dist 7.0935 6.65921 6.15305 7.11037 5.77749 6.06674 numMergedOcc 0
25 mol 240 unq 1 iso 0 dist 7.0935 10.6145 8.0951 7.11037 5.77749 5.24608 numMergedOcc 0
26 mol 241 unq 0 iso 0 dist 6.97756 8.28913 6.83797 3.96499 7.52531 7.5936 numMergedOcc 0
27 mol 257 unq 0 iso 0 dist 8.95261 9.63067 7.14834 7.65595 9.6834 4.46167 numMergedOcc 0
28 mol 257 unq 1 iso 0 dist 7.80336 5.47761 7.14834 3.41163 9.6834 4.46167 numMergedOcc 0
29 mol 277 unq 0 iso 0 dist 9.64889 10.971 9.41725 13.4595 4.9764 13.6468 numMergedOcc 0
30 mol 277 unq 1 iso 0 dist 9.64889 10.971 9.41725 13.6295 6.36559 13.3297 numMergedOcc 0
