0 mol 30 unq 0 iso 0 dist 8.18794 6.59376 4.83516 5.9029 9.81761 10.9154 numMergedOcc 0
1 mol 32 unq 0 iso 0 dist 7.13608 4.95327 5.07181 8.69625 8.07997 9.58107 numMergedOcc 0
2 mol 46 unq 0 iso 0 dist 7.43338 8.32948 5.5471 6.5207 6.02472 10.6515 numMergedOcc 0
3 mol 48 unq 0 iso 0 dist 9.78023 9.79657 6.26827 7.73842 8.50475 9.48288 numMergedOcc 0
4 mol 48 unq 1 iso 0 dist 9.79657 9.78023 6.26827 7.73842 9.48288 8.50475 numMergedOcc 0
5 mol 64 unq 0 iso 0 dist 5.45684 7.66372 4.78627 6.11938 5.94373 9.97062 numMergedOcc 0
6 mol 64 unq 1 iso 0 dist 7.76644 9.99743 4.78627 4.43442 5.94373 9.97062 numMergedOcc 0
7 mol 98 unq 0 iso 0 dist 7.88143 6.62952 8.21408 4.81103 7.67564 8.60103 numMergedOcc 0
8 mol 98 unq 1 iso 0 dist 6.62952 7.88143 8.21408 4.81103 8.60103 7.67564 numMergedOcc 0
9 mol 125 unq 0 iso 0 dist 8.44933 7.43803 4.6635 5.61158 8.74577 9.7728 numMergedOcc 0
10 mol 125 unq 1 iso 0 dist 7.43803 8.44933 4.6635 6.27138 9.94322 10.7546 numMergedOcc 0
11 mol 125 unq 2 iso 0 dist 7.43803 8.44933 4.6635 5.61158 9.7728 8.74577 numMergedOcc 0
12 mol 174 unq 0 iso 0 dist 9.56869 7.37131 5.33032 10.981 8.39178 12.2017 numMergedOcc 0
13 mol 174 unq 1 iso 0 dist 9.56869 7.37131 5.33032 13.6211 7.54918 12.5389 numMergedOcc 0
14 mol 203 unq 0 iso 0 dist 7.72215 5.46529 5.73409 5.39235 8.8083 9.78421 numMergedOcc 0
15 mol 203 unq 1 iso 0 dist 9.47882 8.60067 11.2093 10.2674 9.34092 17.0658 numMergedOcc 0
16 mol 209 unq 0 iso 0 dist 8.12326 6.74526 5.00665 5.78532 8.64079 10.3753 numMergedOcc 0
17 mol 209 unq 1 iso 0 dist 7.37014 8.68691 5.00665 4.84945 8.64079 10.3753 numMergedOcc 0
18 mol 209 unq 2 iso 0 dist 8.20431 8.8886 8.77944 5.54278 8.64079 8.76128 numMergedOcc 0
19 mol 209 unq 3 iso 0 dist 8.8886 8.20431 8.77944 5.54278 8.76128 8.64079 numMergedOcc 0
20 mol 273 unq 0 iso 0 dist 7.84151 7.85797 12.9925 5.63899 9.16554 9.65597 numMergedOcc 0
21 mol 273 unq 1 iso 0 dist 7.84151 7.85797 12.9925 7.46111 8.83491 15.3163 numMergedOcc 0
22 mol 273 unq 2 iso 0 dist 7.85797 7.84151 12.9925 5.63899 9.65597 9.16554 numMergedOcc 0
