0 mol 21 unq 0 iso 0 dist 9.35137 5.93898 4.32991 10.6971 6.61889 6.28263 numMergedOcc 0
1 mol 21 unq 1 iso 0 dist 7.81429 5.93898 9.28636 10.6971 14.2242 6.28263 numMergedOcc 0
2 mol 21 unq 2 iso 0 dist 9.39415 5.93898 8.91628 10.6971 11.7242 6.28263 numMergedOcc 0
3 mol 73 unq 0 iso 0 dist 9.33919 9.73086 10.4668 5.11416 10.462 6.14542 numMergedOcc 0
4 mol 73 unq 1 iso 0 dist 9.79143 8.68662 12.8099 6.56633 10.462 8.96616 numMergedOcc 0
5 mol 73 unq 2 iso 0 dist 9.79143 7.4369 10.4668 6.56633 10.462 6.14542 numMergedOcc 0
6 mol 100 unq 0 iso 0 dist 4.5985 9.90751 10.3433 6.12107 8.95014 7.81446 numMergedOcc 0
7 mol 100 unq 1 iso 0 dist 4.5985 9.21662 8.59989 6.12107 8.95014 6.55173 numMergedOcc 0
8 mol 100 unq 2 iso 0 dist 4.5985 9.21662 8.59989 5.42531 6.84692 6.59691 numMergedOcc 0
9 mol 119 unq 0 iso 0 dist 9.70093 8.95212 10.9729 5.13589 13.9942 8.67537 numMergedOcc 0
10 mol 119 unq 1 iso 0 dist 6.69217 7.64052 10.9729 12.0175 13.9942 8.67537 numMergedOcc 0
11 mol 133 unq 0 iso 0 dist 4.51266 8.77023 13.2024 4.54648 6.49688 8.83732 numMergedOcc 0
12 mol 134 unq 0 iso 0 dist 6.50009 9.10524 4.20094 6.98221 7.20601 7.83568 numMergedOcc 0
13 mol 134 unq 1 iso 0 dist 8.65986 9.00918 15.3248 14.2198 18.8787 7.83568 numMergedOcc 0
14 mol 170 unq 0 iso 0 dist 6.36868 9.08274 5.40635 9.275 8.20406 6.47164 numMergedOcc 0
15 mol 170 unq 1 iso 0 dist 6.36868 9.08274 5.40635 12.5696 13.1614 9.65126 numMergedOcc 0
16 mol 181 unq 0 iso 0 dist 8.47008 6.64173 7.11838 5.63555 6.2176 8.12266 numMergedOcc 0
17 mol 181 unq 1 iso 0 dist 8.47008 9.01624 8.25265 7.20191 10.9996 5.99437 numMergedOcc 0
18 mol 181 unq 2 iso 0 dist 8.47008 9.55105 5.42919 5.63555 6.2176 9.43306 numMergedOcc 0
19 mol 181 unq 3 iso 0 dist 8.47008 9.55105 5.42919 7.20191 10.9996 8.4848 numMergedOcc 0
20 mol 186 unq 0 iso 0 dist 8.64379 7.2793 7.32479 10.5063 12.9667 6.88127 numMergedOcc 0
21 mol 198 unq 0 iso 0 dist 5.82585 9.31526 5.02597 9.73871 6.50352 8.63279 numMergedOcc 0
22 mol 234 unq 0 iso 0 dist 6.35438 7.81215 4.76962 10.0059 9.38888 7.77911 numMergedOcc 0
23 mol 234 unq 1 iso 0 dist 9.07916 5.64285 5.43679 5.08515 10.1769 7.77911 numMergedOcc 0
24 mol 234 unq 2 iso 0 dist 9.57132 5.64285 4.76962 5.08515 9.38888 7.77911 numMergedOcc 0
25 mol 235 unq 0 iso 0 dist 7.48753 8.19317 5.67913 6.82855 11.8185 8.97952 numMergedOcc 0
26 mol 239 unq 0 iso 0 dist 5.45139 6.73665 7.77371 11.169 6.85567 8.95511 numMergedOcc 0
27 mol 239 unq 1 iso 0 dist 5.45139 6.73665 7.77371 5.88931 10.0009 5.85002 numMergedOcc 0
28 mol 273 unq 0 iso 0 dist 9.82018 9.59325 4.04219 4.60101 6.83684 6.35532 numMergedOcc 0
29 mol 274 unq 0 iso 0 dist 8.11169 9.30212 10.5817 9.5468 15.4791 7.77765 numMergedOcc 0
30 mol 274 unq 1 iso 0 dist 8.11169 6.4611 14.0768 9.5468 15.4791 9.65868 numMergedOcc 0
31 mol 274 unq 2 iso 0 dist 8.11169 6.4611 14.0768 6.70925 9.1028 8.60027 numMergedOcc 0
32 mol 274 unq 3 iso 0 dist 8.73167 9.30212 11.8445 9.5468 9.4335 7.77765 numMergedOcc 0
33 mol 274 unq 4 iso 0 dist 8.73167 6.4611 10.2248 9.5468 9.4335 9.65868 numMergedOcc 0
34 mol 274 unq 5 iso 0 dist 8.73167 6.4611 10.2248 6.70925 14.6426 8.60027 numMergedOcc 0
