C,1,18.52,s,
C,2,35.16,s,
C,3,32.0,s,
C,4,30.1,s,
C,5,37.2,s,
C,6,40.4,s,
C,7,18.87,s,
C,8,,,
O,9,,,
C,10,40.4,s,
C,11,,,
O,12,,,
H,13,0.92,d,6.5
H,14,0.92,d,6.5
H,15,0.92,d,6.5
H,16,1.68,m,"6.5,5.0,0.5"
H,17,1.45,m,
H,18,1.45,m,
H,19,1.58,m,
H,20,1.58,m,
H,21,1.86,m,
H,22,2.83,qdd,"6.7,5.6,1.3"
H,23,1.03,d,6.7
H,24,1.03,d,6.7
H,25,1.03,d,6.7
H,26,9.54,d,1.3
H,27,2.83,ddd,"9.4,6.5,1.3"
H,28,9.54,d,1.3
