C,1,51.75,s,
O,2,,,
C,3,86.9,s,
C,4,35.22,s,
C,5,28.16,s,
C,6,50.93,s,
C,7,55.44,s,
N,8,,,
C,9,49.91,s,
C,10,31.61,s,
C,11,19.12,s,
C,12,44.58,s,
C,13,20.01,s,
C,14,64.95,s,
C,15,49.71,s,
C,16,22.45,s,
C,17,63.92,s,
C,18,33.49,s,
C,19,25.5,s,
C,20,136.42,s,
C,21,176.73,s,
C,22,,,
O,23,,,
C,24,48.61,s,
C,25,,,
O,26,,,
H,27,3.31,s,
H,28,3.31,s,
H,29,3.31,s,
H,30,1.9,ddd,"12.4,10.1,5.3"
H,31,1.9,ddd,"12.4,10.6,1.6"
H,32,1.58,m,
H,33,1.58,m,
H,34,2.34,m,
H,35,2.88,dd,"10.9,9.4"
H,36,2.88,dd,"9.4,4.6"
H,37,2.73,dd,"12.4,6.8"
H,38,2.73,dd,"12.4,9.1"
H,39,2.75,m,
H,40,1.04,d,6.5
H,41,1.04,d,6.5
H,42,1.04,d,6.5
H,43,2.25,ddd,"3.2,3.1,0.7"
H,44,2.17,ddd,"12.4,3.1,2.5"
H,45,2.17,ddd,"12.4,3.3,3.2"
H,46,3.51,dd,"3.3,2.5"
H,47,1.27,s,
H,48,1.27,s,
H,49,1.27,s,
H,50,2.23,ddd,"12.4,6.5,1.5"
H,51,2.23,ddd,"13.2,12.4,5.9"
H,52,2.42,ddd,"12.4,5.9,1.5"
H,53,2.42,ddd,"13.2,12.4,6.5"
H,54,2.84,s,
H,55,2.84,s,
