C,1,18.52,s,
C,2,35.16,s,
C,3,35.12,s,
C,4,71.11,s,
O,5,,,
C,6,47.92,s,
C,7,36.6,s,
C,8,31.95,s,
C,9,31.95,s,
C,10,51.86,s,
C,11,34.96,s,
C,12,21.51,s,
C,13,35.28,s,
C,14,28.16,s,
C,15,46.95,s,
C,16,90.1,s,
O,17,,,
H,18,0.92,d,6.5
H,19,0.92,d,6.5
H,20,0.92,d,6.5
H,21,1.68,m,
H,22,1.88,ddd,"12.4,8.1,1.5"
H,23,1.88,ddd,"12.4,8.9,1.6"
H,24,4.19,ddd,"8.1,5.8,1.6"
H,25,,,
H,26,3.07,d,5.8
H,27,1.0,s,
H,28,1.0,s,
H,29,1.0,s,
H,30,1.0,s,
H,31,1.0,s,
H,32,1.0,s,
H,33,2.05,s,
H,34,2.05,s,
H,35,1.13,s,
H,36,1.13,s,
H,37,1.13,s,
H,38,1.72,ddd,"12.4,11.1,7.9"
H,39,1.72,ddd,"12.4,12.0,3.2"
H,40,1.58,m,
H,41,1.58,m,
H,42,2.13,ddd,"10.2,8.3,3.7"
H,43,,,
