C,1,25.43,s,
C,2,43.0,s,
C,3,25.43,s,
C,4,49.84,s,
C,5,,,
O,6,,,
C,7,48.61,s,
C,8,88.44,s,
C,9,18.58,s,
O,10,,,
C,11,77.48,s,
C,12,25.81,s,
C,13,35.22,s,
C,14,35.28,s,
C,15,49.9,s,
C,16,44.86,s,
C,17,67.05,s,
Cl,18,,,
H,19,1.13,s,
H,20,1.13,s,
H,21,1.13,s,
H,22,1.13,s,
H,23,1.13,s,
H,24,1.13,s,
H,25,2.57,s,
H,26,2.57,s,
H,27,2.84,s,
H,28,2.84,s,
H,29,1.4,s,
H,30,1.4,s,
H,31,1.4,s,
H,32,1.4,s,
H,33,1.4,s,
H,34,1.4,s,
H,35,1.9,ddd,"12.4,11.9,3.9"
H,36,1.9,ddd,"12.4,11.9,5.8"
H,37,1.72,ddd,"12.4,11.9,3.9"
H,38,1.72,ddd,"12.4,11.9,5.8"
H,39,3.06,dd,"12.4,6.5"
H,40,3.06,dd,"12.4,10.5"
H,41,4.47,dd,"10.5,6.5"
