0 mol 17 unq 0 iso 0 dist 9.84612 11.1103 7.25951 9.55169 5.67637 9.78331 numMergedOcc 0
1 mol 26 unq 0 iso 0 dist 7.90324 9.70974 6.93197 12.3456 7.23703 6.46104 numMergedOcc 0
2 mol 26 unq 1 iso 0 dist 7.90324 9.70974 6.93197 12.9819 5.81765 7.36856 numMergedOcc 0
3 mol 98 unq 0 iso 0 dist 9.66226 7.65932 7.36769 12.9741 7.94178 6.7117 numMergedOcc 0
4 mol 98 unq 1 iso 0 dist 9.66226 7.65932 7.36769 11.233 9.85543 4.47349 numMergedOcc 0
5 mol 98 unq 2 iso 0 dist 9.66226 7.65932 7.36769 9.48388 7.28361 5.65185 numMergedOcc 0
6 mol 100 unq 0 iso 0 dist 5.38064 10.5343 9.5057 13.1295 10.6848 7.01812 numMergedOcc 0
7 mol 100 unq 1 iso 0 dist 5.38064 10.5343 9.5057 16.3047 15.3454 8.30845 numMergedOcc 0
8 mol 102 unq 0 iso 0 dist 8.48638 4.26679 8.88394 5.79411 4.48396 8.31932 numMergedOcc 0
9 mol 171 unq 0 iso 0 dist 8.53734 13.6177 5.25109 11.4309 4.78075 6.64834 numMergedOcc 0
10 mol 171 unq 1 iso 0 dist 8.53734 13.6177 5.25109 15.9529 7.9651 5.93786 numMergedOcc 0
11 mol 171 unq 2 iso 0 dist 8.53734 13.6177 5.25109 21.0527 12.6853 8.24693 numMergedOcc 0
12 mol 171 unq 3 iso 0 dist 8.53734 13.6177 5.25109 11.3811 5.90026 7.36698 numMergedOcc 0
13 mol 171 unq 4 iso 0 dist 8.53734 16.0184 8.21618 15.9529 7.9651 8.1344 numMergedOcc 0
14 mol 171 unq 5 iso 0 dist 8.53734 16.0184 8.21618 21.0527 12.6853 6.71356 numMergedOcc 0
15 mol 171 unq 6 iso 0 dist 6.08141 9.13275 5.25109 10.5291 4.78075 6.64834 numMergedOcc 0
16 mol 171 unq 7 iso 0 dist 6.08141 9.13275 5.25109 13.5733 7.9651 5.93786 numMergedOcc 0
17 mol 171 unq 8 iso 0 dist 6.08141 9.13275 5.25109 17.2679 12.6853 8.24693 numMergedOcc 0
18 mol 171 unq 9 iso 0 dist 6.08141 9.13275 5.25109 8.68992 5.90026 7.36698 numMergedOcc 0
19 mol 171 unq 10 iso 0 dist 6.08141 11.3808 8.21618 13.5733 7.9651 8.1344 numMergedOcc 0
20 mol 171 unq 11 iso 0 dist 6.08141 11.3808 8.21618 17.2679 12.6853 6.71356 numMergedOcc 0
21 mol 181 unq 0 iso 0 dist 9.89987 5.16569 7.32087 11.1528 7.81713 6.46704 numMergedOcc 0
22 mol 181 unq 1 iso 0 dist 9.89987 14.8476 8.86197 11.1528 7.81713 6.59025 numMergedOcc 0
23 mol 232 unq 0 iso 0 dist 8.70651 4.03628 9.8664 6.94983 4.9377 9.05071 numMergedOcc 0
24 mol 238 unq 0 iso 0 dist 6.38654 3.99122 5.92374 10.2338 8.1195 8.69104 numMergedOcc 0
25 mol 238 unq 1 iso 0 dist 9.77185 11.3383 5.92374 15.4647 8.1195 8.69104 numMergedOcc 0
26 mol 271 unq 0 iso 0 dist 8.97962 5.88597 5.92274 7.59727 8.66946 9.70714 numMergedOcc 0
27 mol 280 unq 0 iso 0 dist 9.44925 11.4465 6.73712 7.47799 6.19336 9.76787 numMergedOcc 0
28 mol 284 unq 0 iso 0 dist 9.95662 6.4111 7.34931 11.0889 4.50325 6.78191 numMergedOcc 0
