C,1,15.6,s,
C,2,43.68,s,
C,3,42.19,s,
C,4,55.2,s,
C,5,45.75,s,
C,6,25.35,s,
C,7,26.6,s,
C,8,47.4,s,
N,9,,,
C,10,47.1,s,
C,11,20.7,s,
C,12,23.5,s,
C,13,32.6,s,
C,14,68.5,s,
O,15,,,
C,16,35.12,s,
C,17,49.28,s,
C,18,,,
O,19,,,
H,20,1.12,d,6.6
H,21,1.12,d,6.6
H,22,1.12,d,6.6
H,23,2.78,ddq,"10.9,6.8,6.6"
H,24,2.02,dd,"12.4,10.9"
H,25,2.02,dd,"12.4,6.8"
H,26,2.83,ddd,"11.2,6.9,2.8"
H,27,1.58,m,
H,28,1.58,m,
H,29,1.56,m,
H,30,1.56,m,
H,31,1.69,ddd,"12.4,8.7,8.6"
H,32,1.69,ddd,"12.4,9.3,1.5"
H,33,2.9,ddd,"12.4,7.4,1.7"
H,34,2.9,ddd,"12.8,12.4,3.6"
H,35,1.56,m,
H,36,1.56,m,
H,37,1.58,m,
H,38,1.58,m,
H,39,2.93,ddd,"10.8,7.6,6.0"
H,40,4.19,ddd,"6.0,5.6,1.7"
H,41,,,
H,42,1.88,ddd,"12.4,10.7,1.7"
H,43,1.88,ddd,"12.4,5.6,1.6"
H,44,2.8,ddd,"10.7,2.8,1.6"
