0 mol 1 unq 0 iso 0 dist 8.69605 6.2936 5.19589 7.69087 11.2961 7.46399 numMergedOcc 0
1 mol 67 unq 0 iso 0 dist 6.12267 7.41937 4.26531 7.28199 11.1591 9.30836 numMergedOcc 0
2 mol 67 unq 1 iso 0 dist 6.12267 6.07108 6.56501 7.28199 11.1591 6.58279 numMergedOcc 0
3 mol 67 unq 2 iso 0 dist 8.27009 8.17929 4.26531 10.2575 11.1591 9.30836 numMergedOcc 0
4 mol 67 unq 3 iso 0 dist 8.27009 5.63802 6.56501 10.2575 11.1591 6.58279 numMergedOcc 0
5 mol 67 unq 4 iso 0 dist 5.80736 8.17929 5.92208 10.2575 10.5819 9.30836 numMergedOcc 0
6 mol 67 unq 5 iso 0 dist 5.80736 5.63802 4.53519 10.2575 10.5819 6.58279 numMergedOcc 0
7 mol 67 unq 6 iso 0 dist 8.43162 7.41937 11.1043 7.28199 11.3283 9.30836 numMergedOcc 0
8 mol 67 unq 7 iso 0 dist 8.43162 6.07108 12.2002 7.28199 11.3283 6.58279 numMergedOcc 0
9 mol 73 unq 0 iso 0 dist 8.90896 6.66506 5.00474 8.49428 11.8778 6.91141 numMergedOcc 0
10 mol 83 unq 0 iso 0 dist 7.72515 7.65069 7.26402 14.9082 15.1489 9.50228 numMergedOcc 0
11 mol 100 unq 0 iso 0 dist 9.52754 6.56978 5.02461 7.66248 13.5143 9.1593 numMergedOcc 0
12 mol 109 unq 0 iso 0 dist 8.53914 9.13614 6.12935 5.74375 11.8441 9.10677 numMergedOcc 0
13 mol 116 unq 0 iso 0 dist 6.53824 9.2638 10.5909 13.3535 15.548 6.63731 numMergedOcc 0
14 mol 116 unq 1 iso 0 dist 6.61973 9.2638 6.2875 13.3535 11.8445 6.63731 numMergedOcc 0
15 mol 220 unq 0 iso 0 dist 9.89039 7.46122 9.36068 9.69089 15.4017 9.05637 numMergedOcc 0
16 mol 220 unq 1 iso 0 dist 8.57174 7.46122 15.6078 9.69089 17.0101 9.05637 numMergedOcc 0
17 mol 230 unq 0 iso 0 dist 9.14989 9.07808 4.32112 5.98989 10.3569 8.58275 numMergedOcc 0
18 mol 230 unq 1 iso 0 dist 9.14989 9.07808 4.32112 7.70123 9.17138 8.78693 numMergedOcc 0
19 mol 232 unq 0 iso 0 dist 6.77822 6.83927 4.06349 6.32212 9.6048 6.67239 numMergedOcc 0
20 mol 232 unq 1 iso 0 dist 6.77822 9.25162 9.4234 6.32212 9.6048 6.23146 numMergedOcc 0
