0 mol 48 unq 0 iso 0 dist 8.38139 9.95208 6.53592 9.07283 3.42062 4.48872 5.7037 6.77802 11.8252 9.05737 numMergedOcc 0
1 mol 62 unq 0 iso 0 dist 6.84323 8.09973 5.90259 6.58981 4.29679 3.73834 3.66673 6.51901 7.16844 4.46067 numMergedOcc 0
2 mol 62 unq 1 iso 0 dist 7.24768 8.09973 6.38075 6.58981 8.07308 3.73834 3.66673 9.1926 7.16844 4.46067 numMergedOcc 0
3 mol 62 unq 2 iso 0 dist 8.51622 8.09973 10.3714 6.58981 10.3525 3.73834 3.66673 10.8493 7.16844 4.46067 numMergedOcc 0
4 mol 63 unq 0 iso 0 dist 9.22609 8.53833 3.79852 9.56838 13.469 10.1907 11.1855 11.8965 8.78414 9.13228 numMergedOcc 0
5 mol 85 unq 0 iso 0 dist 7.52742 6.24296 8.175 8.15861 7.14242 3.65186 3.81285 6.56288 4.29937 6.67137 numMergedOcc 0
6 mol 85 unq 1 iso 0 dist 7.52742 6.24296 8.175 8.15861 7.14242 3.65186 6.17121 5.97559 5.37869 7.04244 numMergedOcc 0
7 mol 85 unq 2 iso 0 dist 7.52742 6.24296 8.175 9.27814 15.6495 14.6387 11.9486 19.0105 16.4531 4.18248 numMergedOcc 0
8 mol 85 unq 3 iso 0 dist 7.52742 6.83218 9.3414 8.15861 7.14242 7.00044 3.81285 6.56288 3.65628 6.67137 numMergedOcc 0
9 mol 85 unq 4 iso 0 dist 7.52742 6.83218 9.3414 8.15861 7.14242 7.00044 6.17121 5.97559 4.05415 7.04244 numMergedOcc 0
10 mol 85 unq 5 iso 0 dist 7.52742 6.83218 9.3414 9.27814 15.6495 15.2529 11.9486 19.0105 16.7975 4.18248 numMergedOcc 0
11 mol 93 unq 0 iso 0 dist 5.27541 9.43355 8.99253 8.61597 13.113 13.6138 6.46195 10.4659 9.40687 9.66837 numMergedOcc 0
12 mol 93 unq 1 iso 0 dist 5.27541 5.64141 3.78587 8.61597 13.113 12.3588 6.46195 10.4659 8.84576 9.66837 numMergedOcc 0
13 mol 93 unq 2 iso 0 dist 5.27541 5.46186 10.5386 8.61597 13.113 4.98621 6.46195 10.4659 7.39732 9.66837 numMergedOcc 0
14 mol 116 unq 0 iso 0 dist 8.56629 6.99944 9.33056 8.55413 11.987 3.43966 9.53399 15.9742 7.54274 6.55227 numMergedOcc 0
15 mol 116 unq 1 iso 0 dist 7.56091 6.99944 4.01797 8.55413 6.88393 3.43966 9.53399 11.4135 7.54274 6.55227 numMergedOcc 0
16 mol 283 unq 0 iso 0 dist 9.74822 8.106 9.46362 7.17276 9.8348 3.12129 6.30031 13.1238 10.0396 7.31132 numMergedOcc 0
17 mol 287 unq 0 iso 0 dist 5.06731 9.98518 11.2805 8.15636 6.00938 16.9188 11.4888 11.2189 21.2166 6.24487 numMergedOcc 0
18 mol 288 unq 0 iso 0 dist 5.06731 9.98518 11.2805 8.15636 6.00938 16.9188 11.4888 11.2189 21.2166 6.24487 numMergedOcc 0
19 mol 289 unq 0 iso 0 dist 5.06731 9.98518 11.2805 8.15636 6.00938 16.9188 11.4888 11.2189 21.2166 6.24487 numMergedOcc 0
