0 mol 10 unq 0 iso 0 dist 6.31531 4.64029 9.29504 12.7255 9.39017 12.9719 numMergedOcc 0
1 mol 12 unq 0 iso 0 dist 5.25583 5.77108 6.6051 4.12573 6.6691 7.81704 numMergedOcc 0
2 mol 12 unq 1 iso 0 dist 5.25583 5.77108 6.6051 5.83262 9.23807 11.1322 numMergedOcc 0
3 mol 12 unq 2 iso 0 dist 5.25583 5.77108 6.6051 10.5333 9.52857 13.5603 numMergedOcc 0
4 mol 12 unq 3 iso 0 dist 5.25583 8.27891 8.15864 4.12573 6.6691 12.0704 numMergedOcc 0
5 mol 12 unq 4 iso 0 dist 5.25583 8.27891 8.15864 5.83262 9.23807 12.4138 numMergedOcc 0
6 mol 12 unq 5 iso 0 dist 5.25583 8.27891 8.15864 10.5333 9.52857 4.40652 numMergedOcc 0
7 mol 48 unq 0 iso 0 dist 7.99735 13.11 9.53081 4.31769 8.82709 10.7098 numMergedOcc 0
8 mol 48 unq 1 iso 0 dist 9.7516 4.99432 9.53081 7.10894 8.82709 10.7098 numMergedOcc 0
9 mol 83 unq 0 iso 0 dist 9.90769 15.5212 7.2118 7.07917 5.68212 10.4465 numMergedOcc 0
10 mol 116 unq 0 iso 0 dist 5.58346 8.38134 6.53824 5.27853 8.3971 10.4136 numMergedOcc 0
11 mol 116 unq 1 iso 0 dist 7.09179 8.38134 6.61973 5.27853 6.74026 10.4136 numMergedOcc 0
12 mol 116 unq 2 iso 0 dist 6.24768 5.88698 6.53824 11.0498 8.3971 10.4136 numMergedOcc 0
13 mol 116 unq 3 iso 0 dist 9.31875 5.88698 6.61973 11.0498 6.74026 10.4136 numMergedOcc 0
14 mol 124 unq 0 iso 0 dist 8.45451 12.0208 7.18976 4.31676 9.5436 10.1583 numMergedOcc 0
15 mol 147 unq 0 iso 0 dist 9.89646 12.352 5.32865 11.7737 7.08651 5.96025 numMergedOcc 0
16 mol 147 unq 1 iso 0 dist 9.89646 12.352 5.32865 15.5134 6.78887 5.19485 numMergedOcc 0
17 mol 147 unq 2 iso 0 dist 9.9332 10.4422 5.32865 8.8506 7.08651 5.96025 numMergedOcc 0
18 mol 147 unq 3 iso 0 dist 9.9332 10.4422 5.32865 13.6758 6.78887 5.19485 numMergedOcc 0
19 mol 174 unq 0 iso 0 dist 8.36618 9.60153 8.16228 6.07412 8.39178 6.97204 numMergedOcc 0
20 mol 174 unq 1 iso 0 dist 8.36618 9.60153 8.16228 7.20832 7.54918 9.84841 numMergedOcc 0
21 mol 181 unq 0 iso 0 dist 7.90753 7.11843 9.40718 10.5065 9.2933 14.1039 numMergedOcc 0
22 mol 181 unq 1 iso 0 dist 7.90753 7.11843 9.40718 6.04759 8.77781 5.39949 numMergedOcc 0
23 mol 192 unq 0 iso 0 dist 8.27545 4.2039 6.2016 5.97774 8.29166 8.67274 numMergedOcc 0
24 mol 192 unq 1 iso 0 dist 8.27545 4.2039 6.2016 15.3045 8.14859 13.2917 numMergedOcc 0
25 mol 192 unq 2 iso 0 dist 8.27545 4.2039 6.2016 11.5774 5.62421 10.3343 numMergedOcc 0
26 mol 229 unq 0 iso 0 dist 8.57691 7.3667 8.4208 7.41397 9.55385 4.65019 numMergedOcc 0
27 mol 236 unq 0 iso 0 dist 7.61854 11.7831 8.63249 12.8555 5.91739 11.7955 numMergedOcc 0
28 mol 236 unq 1 iso 0 dist 7.61854 8.73194 7.74348 12.8555 5.91739 8.52618 numMergedOcc 0
29 mol 281 unq 0 iso 0 dist 8.19366 7.19125 4.75349 7.65583 7.85707 6.79166 numMergedOcc 0
