0 mol 0 unq 0 iso 0 dist 9.42137 7.31837 5.24778 7.65884 9.23213 8.34244 numMergedOcc 0
1 mol 26 unq 0 iso 0 dist 9.7522 8.99751 10.797 10.7581 12.0096 7.22361 numMergedOcc 0
2 mol 26 unq 1 iso 0 dist 9.7522 8.99751 10.797 6.77783 13.2086 6.15893 numMergedOcc 0
3 mol 26 unq 2 iso 0 dist 9.7522 9.44507 10.9837 6.77783 13.2086 5.497 numMergedOcc 0
4 mol 54 unq 0 iso 0 dist 5.97635 4.38047 4.29856 8.98505 5.02241 6.30987 numMergedOcc 0
5 mol 58 unq 0 iso 0 dist 6.36193 5.84625 9.95364 10.3974 16.3613 7.6481 numMergedOcc 0
6 mol 58 unq 1 iso 0 dist 6.36193 5.84625 9.95364 9.80755 11.5023 9.11258 numMergedOcc 0
7 mol 58 unq 2 iso 0 dist 4.88613 5.84625 5.49591 10.3974 12.7237 7.6481 numMergedOcc 0
8 mol 58 unq 3 iso 0 dist 4.88613 5.84625 5.49591 9.80755 8.89374 9.11258 numMergedOcc 0
9 mol 59 unq 0 iso 0 dist 9.59244 7.69638 11.1914 4.07863 6.23899 9.43355 numMergedOcc 0
10 mol 64 unq 0 iso 0 dist 8.99491 6.23138 6.21578 6.84612 8.68586 9.32552 numMergedOcc 0
11 mol 74 unq 0 iso 0 dist 9.99155 7.26263 8.1988 3.94075 8.96501 8.48471 numMergedOcc 0
12 mol 115 unq 0 iso 0 dist 4.98864 6.66022 5.22052 5.46352 6.99777 5.60389 numMergedOcc 0
13 mol 119 unq 0 iso 0 dist 7.91337 8.4733 5.92984 6.02826 7.39889 7.26955 numMergedOcc 0
14 mol 119 unq 1 iso 0 dist 6.40546 8.4733 7.45148 6.02826 10.5042 7.26955 numMergedOcc 0
15 mol 126 unq 0 iso 0 dist 8.32241 8.97111 6.0268 4.56139 7.75534 7.36017 numMergedOcc 0
16 mol 133 unq 0 iso 0 dist 5.86531 6.42904 5.92062 5.80615 7.92688 6.51868 numMergedOcc 0
17 mol 157 unq 0 iso 0 dist 6.1835 9.30128 8.0238 9.06676 11.5477 6.455 numMergedOcc 0
18 mol 175 unq 0 iso 0 dist 8.58906 7.42278 7.68909 4.65504 10.9584 7.04177 numMergedOcc 0
19 mol 181 unq 0 iso 0 dist 9.58911 5.66363 11.85 7.58472 14.8211 5.95304 numMergedOcc 0
20 mol 232 unq 0 iso 0 dist 7.70279 9.41148 6.2188 6.17401 7.07392 7.10413 numMergedOcc 0
21 mol 232 unq 1 iso 0 dist 9.29752 9.41148 12.5452 6.17401 11.5589 7.10413 numMergedOcc 0
22 mol 253 unq 0 iso 0 dist 7.15815 9.69704 5.78064 8.75798 7.19465 9.58354 numMergedOcc 0
23 mol 270 unq 0 iso 0 dist 7.82003 8.55914 5.43023 6.41275 8.25349 7.89388 numMergedOcc 0
24 mol 274 unq 0 iso 0 dist 6.55855 6.83113 5.64601 5.95459 9.19234 9.20749 numMergedOcc 0
25 mol 274 unq 1 iso 0 dist 9.52894 6.83113 10.5941 5.95459 14.3124 9.20749 numMergedOcc 0
