0 mol 10 unq 0 iso 0 dist 6.02543 11.4402 9.39486 5.40169 3.92592 9.43029 numMergedOcc 0
1 mol 26 unq 0 iso 0 dist 7.90721 4.39827 8.96682 13.6618 12.358 9.96912 numMergedOcc 0
2 mol 34 unq 0 iso 0 dist 9.58596 12.3532 4.58552 10.5969 5.70782 6.88052 numMergedOcc 0
3 mol 79 unq 0 iso 0 dist 8.04168 9.34648 8.7515 9.72007 4.53016 7.43127 numMergedOcc 0
4 mol 112 unq 0 iso 0 dist 7.34602 9.02942 6.96745 15.0269 10.6938 7.67238 numMergedOcc 0
5 mol 112 unq 1 iso 0 dist 5.43933 10.4065 6.96745 15.5663 10.3457 8.06134 numMergedOcc 0
6 mol 112 unq 2 iso 0 dist 5.43933 10.4065 6.96745 9.34178 3.99855 5.36587 numMergedOcc 0
7 mol 134 unq 0 iso 0 dist 5.11043 4.935 8.62504 9.30061 6.93712 9.0176 numMergedOcc 0
8 mol 141 unq 0 iso 0 dist 6.77921 5.25982 7.92216 4.46777 3.98068 5.92302 numMergedOcc 0
9 mol 141 unq 1 iso 0 dist 6.77921 5.25982 7.92216 6.94988 10.1551 5.29898 numMergedOcc 0
10 mol 143 unq 0 iso 0 dist 8.68663 15.2605 9.29944 17.8758 10.0079 5.06564 numMergedOcc 0
11 mol 143 unq 1 iso 0 dist 8.68663 15.2605 9.29944 17.012 9.05366 7.5373 numMergedOcc 0
12 mol 170 unq 0 iso 0 dist 9.00677 9.3696 8.75024 10.9369 5.04147 6.47164 numMergedOcc 0
13 mol 170 unq 1 iso 0 dist 9.00677 9.3696 8.75024 16.8758 10.518 9.65126 numMergedOcc 0
14 mol 186 unq 0 iso 0 dist 7.04815 5.40422 5.67168 4.5271 3.87169 6.56416 numMergedOcc 0
15 mol 186 unq 1 iso 0 dist 6.07389 5.40422 5.86483 4.5271 5.65634 6.56416 numMergedOcc 0
16 mol 225 unq 0 iso 0 dist 8.69811 6.37008 6.46405 15.2105 7.96454 9.82043 numMergedOcc 0
17 mol 225 unq 1 iso 0 dist 8.69811 6.37008 6.46405 12.3225 4.45116 8.22922 numMergedOcc 0
18 mol 225 unq 2 iso 0 dist 7.8744 6.05548 9.3502 9.23935 3.94409 9.82043 numMergedOcc 0
19 mol 225 unq 3 iso 0 dist 7.8744 6.05548 9.3502 7.77552 6.88465 8.22922 numMergedOcc 0
20 mol 225 unq 4 iso 0 dist 4.98402 6.05548 6.46405 9.23935 7.96454 9.82043 numMergedOcc 0
21 mol 225 unq 5 iso 0 dist 4.98402 6.05548 6.46405 7.77552 4.45116 8.22922 numMergedOcc 0
22 mol 227 unq 0 iso 0 dist 5.28771 7.3164 6.09335 14.3567 10.5007 9.18728 numMergedOcc 0
23 mol 227 unq 1 iso 0 dist 5.28771 7.3164 6.09335 12.135 12.8337 8.91971 numMergedOcc 0
24 mol 292 unq 0 iso 0 dist 9.2558 11.4284 9.23612 11.9814 5.93687 8.6233 numMergedOcc 0
