C,1,52.11,s,
O,2,,,
C,3,175.49,s,
O,4,,,
C,5,53.2,s,
C,6,37.16,s,
C,7,34.57,s,
C,8,58.7,s,
C,9,130.2,s,
N,10,,,
C,11,136.1,s,
C,12,95.0,s,
C,13,155.65,s,
O,14,,,
C,15,55.34,s,
C,16,108.65,s,
C,17,118.2,s,
C,18,121.9,s,
C,19,107.7,s,
C,20,16.7,s,
C,21,53.19,s,
N,22,,,
C,23,61.91,s,
C,24,41.03,s,
C,25,23.93,s,
C,26,32.64,s,
C,27,67.97,s,
O,28,,,
H,29,3.74,s,
H,30,3.74,s,
H,31,3.74,s,
H,32,3.31,dd,"7.2,5.9"
H,33,2.12,m,
H,34,1.68,ddd,"12.4,11.2,10.2"
H,35,1.68,ddd,"12.4,9.1,1.3"
H,36,4.6,dd,"11.2,1.3"
H,37,,,
H,38,6.85,dd,"1.9,0.5"
H,39,3.88,s,
H,40,3.88,s,
H,41,3.88,s,
H,42,6.84,dd,"6.9,1.9"
H,43,7.55,dd,"6.9,0.5"
H,44,2.54,ddd,"15.4,11.4,4.6"
H,45,2.54,ddd,"15.4,11.3,3.9"
H,46,3.05,ddd,"12.4,11.4,3.9"
H,47,3.05,ddd,"12.4,11.3,4.6"
H,48,3.31,dd,"12.4,7.4"
H,49,3.31,dd,"12.4,11.1"
H,50,3.15,m,
H,51,1.58,m,
H,52,1.58,m,
H,53,1.8,m,
H,54,1.8,m,
H,55,4.19,ddd,"9.5,7.2,5.3"
H,56,,,
