0 mol 4 unq 0 iso 0 dist 6.85308 10.9005 6.12485 10.1982 7.88748 4.10578 numMergedOcc 0
1 mol 4 unq 1 iso 0 dist 6.85308 7.5562 9.04027 10.1982 7.88748 6.87439 numMergedOcc 0
2 mol 17 unq 0 iso 0 dist 8.88042 8.45543 9.5937 4.85734 8.6745 3.79709 numMergedOcc 0
3 mol 17 unq 1 iso 0 dist 8.88042 14.3268 7.34681 4.85734 8.6745 11.8805 numMergedOcc 0
4 mol 21 unq 0 iso 0 dist 6.9745 4.43555 8.07914 7.18502 7.30688 10.1117 numMergedOcc 0
5 mol 21 unq 1 iso 0 dist 6.9745 4.43555 8.07914 6.45009 6.70786 9.53082 numMergedOcc 0
6 mol 21 unq 2 iso 0 dist 6.9745 4.43555 8.07914 5.07926 8.16395 9.20888 numMergedOcc 0
7 mol 24 unq 0 iso 0 dist 4.43439 6.7092 7.69637 6.96755 8.14598 5.37421 numMergedOcc 0
8 mol 29 unq 0 iso 0 dist 9.37221 13.6066 7.50258 9.03591 6.04161 5.97852 numMergedOcc 0
9 mol 48 unq 0 iso 0 dist 9.63751 7.94322 5.06188 11.4038 7.78899 4.55422 numMergedOcc 0
10 mol 182 unq 0 iso 0 dist 7.53236 7.99073 6.38335 5.48777 5.61979 5.2973 numMergedOcc 0
11 mol 211 unq 0 iso 0 dist 8.19203 5.94027 5.6998 5.58028 8.25586 5.41937 numMergedOcc 0
12 mol 225 unq 0 iso 0 dist 9.62052 9.06809 7.65121 18.0531 8.94981 11.8703 numMergedOcc 0
13 mol 225 unq 1 iso 0 dist 9.62052 9.06809 7.65121 11.5294 5.90986 4.88404 numMergedOcc 0
14 mol 225 unq 2 iso 0 dist 9.62052 9.06809 7.65121 11.5753 7.50697 13.6563 numMergedOcc 0
15 mol 226 unq 0 iso 0 dist 7.59794 8.90041 8.74399 10.5605 8.31266 5.27153 numMergedOcc 0
16 mol 236 unq 0 iso 0 dist 8.69109 5.54677 4.71683 9.44971 9.67162 10.7395 numMergedOcc 0
17 mol 259 unq 0 iso 0 dist 5.81378 10.496 8.54422 11.2726 8.40328 11.0103 numMergedOcc 0
18 mol 259 unq 1 iso 0 dist 5.81378 10.496 8.54422 9.26271 8.2518 10.099 numMergedOcc 0
19 mol 259 unq 2 iso 0 dist 5.81378 7.69574 7.67473 11.2726 8.40328 8.71577 numMergedOcc 0
20 mol 259 unq 3 iso 0 dist 5.81378 7.69574 7.67473 9.26271 8.2518 6.47425 numMergedOcc 0
21 mol 283 unq 0 iso 0 dist 6.95897 6.32401 9.243 7.41717 9.83098 13.1215 numMergedOcc 0
22 mol 285 unq 0 iso 0 dist 8.84177 16.2395 7.872 13.536 5.49829 3.05975 numMergedOcc 0
23 mol 285 unq 1 iso 0 dist 8.84177 16.2395 7.872 6.62906 6.24134 11.5704 numMergedOcc 0
24 mol 285 unq 2 iso 0 dist 8.84177 10.7953 6.32984 13.536 5.49829 5.76392 numMergedOcc 0
25 mol 285 unq 3 iso 0 dist 8.84177 10.7953 6.32984 6.62906 6.24134 4.4744 numMergedOcc 0
