C,1,18.22,s,
C,2,37.89,s,
C,3,27.35,s,
C,4,22.66,s,
C,5,34.97,s,
C,6,36.54,s,
C,7,21.2,s,
C,8,35.01,s,
C,9,22.57,s,
C,10,43.82,s,
C,11,37.71,s,
C,12,92.55,s,
O,13,,,
C,14,81.82,s,
C,15,25.61,s,
C,16,25.61,s,
H,17,1.17,d,6.6
H,18,1.17,d,6.6
H,19,1.17,d,6.6
H,20,1.93,dqd,"10.4,6.6,2.8"
H,21,1.58,m,
H,22,1.58,m,
H,23,1.26,m,
H,24,1.26,m,
H,25,1.72,ddd,"12.4,5.6,3.2"
H,26,1.72,ddd,"13.4,12.4,3.0"
H,27,1.13,s,
H,28,1.13,s,
H,29,1.13,s,
H,30,1.72,ddd,"12.4,10.0,7.8"
H,31,1.72,ddd,"12.4,10.0,1.3"
H,32,1.47,m,
H,33,1.47,m,
H,34,1.63,m,
H,35,1.96,dd,"12.4,4.7"
H,36,1.96,dd,"12.4,1.2"
H,37,1.34,s,
H,38,1.34,s,
H,39,1.34,s,
H,40,1.34,s,
H,41,1.34,s,
H,42,1.34,s,
