0 mol 12 unq 0 iso 0 dist 4.85969 8.3933 4.60834 6.13614 8.99098 13.3275 numMergedOcc 0
1 mol 34 unq 0 iso 0 dist 9.12062 4.97286 5.70643 6.00825 5.68877 4.50643 numMergedOcc 0
2 mol 44 unq 0 iso 0 dist 7.73902 9.03899 4.0144 4.83564 6.14602 6.11574 numMergedOcc 0
3 mol 44 unq 1 iso 0 dist 7.73902 9.03899 4.0144 4.29306 7.41011 10.2193 numMergedOcc 0
4 mol 52 unq 0 iso 0 dist 8.72191 8.30668 4.46374 5.17789 9.16078 11.0672 numMergedOcc 0
5 mol 93 unq 0 iso 0 dist 4.45006 7.55854 4.1947 6.69378 8.55124 12.7036 numMergedOcc 0
6 mol 156 unq 0 iso 0 dist 6.72426 8.95171 4.20708 13.2289 9.13184 5.50879 numMergedOcc 0
7 mol 156 unq 1 iso 0 dist 6.72426 8.95171 4.20708 6.91184 7.27593 6.69157 numMergedOcc 0
8 mol 173 unq 0 iso 0 dist 6.46871 7.76428 5.07225 12.0398 9.9855 14.1754 numMergedOcc 0
9 mol 186 unq 0 iso 0 dist 6.76781 8.40335 4.43567 6.29823 6.64749 9.41105 numMergedOcc 0
10 mol 186 unq 1 iso 0 dist 6.22466 5.82681 7.99002 12.2795 8.52322 16.0086 numMergedOcc 0
11 mol 229 unq 0 iso 0 dist 4.38586 7.06416 3.99138 5.55716 9.33775 10.5961 numMergedOcc 0
12 mol 240 unq 0 iso 0 dist 8.96064 5.84605 3.96088 5.01224 7.61364 6.50985 numMergedOcc 0
13 mol 241 unq 0 iso 0 dist 5.66945 9.89398 8.94039 4.51587 7.30582 8.00841 numMergedOcc 0
14 mol 257 unq 0 iso 0 dist 7.5977 8.7632 6.55241 9.42207 9.27027 10.6209 numMergedOcc 0
15 mol 260 unq 0 iso 0 dist 7.46 8.88803 9.87568 7.3067 6.23198 13.9457 numMergedOcc 0
16 mol 260 unq 1 iso 0 dist 6.71406 8.88803 9.94594 7.3067 8.82216 13.9457 numMergedOcc 0
17 mol 271 unq 0 iso 0 dist 9.27556 9.22385 9.86334 5.22029 8.54162 13.1737 numMergedOcc 0
18 mol 271 unq 1 iso 0 dist 9.27556 6.56531 5.60228 5.22029 8.54162 5.76281 numMergedOcc 0
19 mol 277 unq 0 iso 0 dist 6.58667 4.66834 4.80425 10.4217 9.027 7.25282 numMergedOcc 0
20 mol 277 unq 1 iso 0 dist 6.58667 8.90911 10.0416 10.4217 9.027 16.8908 numMergedOcc 0
21 mol 277 unq 2 iso 0 dist 6.01542 4.66834 9.70521 5.57184 7.91992 6.40125 numMergedOcc 0
22 mol 277 unq 3 iso 0 dist 6.01542 8.90911 8.11496 5.57184 7.91992 13.9579 numMergedOcc 0
