C,1,22.7,s,
C,2,171.1,s,
O,3,,,
N,4,,,
C,5,127.9,s,
C,6,147.9,s,
O,7,,,
C,8,118.5,s,
C,9,128.5,s,
C,10,113.8,s,
C,11,140.0,s,
C,12,54.7,s,
C,13,37.0,s,
C,14,53.7,s,
N,15,,,
C,16,41.1,s,
C,17,64.5,s,
C,18,23.2,s,
C,19,26.4,s,
C,20,104.0,s,
C,21,171.5,s,
C,22,65.8,s,
O,23,,,
C,24,171.8,s,
O,25,,,
O,26,,,
C,27,70.2,s,
C,28,34.9,s,
C,29,66.5,s,
H,30,2.28,s,
H,31,2.28,s,
H,32,2.28,s,
H,33,,,
H,34,6.95,dd,"7.5,1.4"
H,35,7.3,dd,"7.6,7.5"
H,36,7.25,dd,"7.6,1.4"
H,37,1.85,ddd,"12.4,11.3,8.6"
H,38,1.85,ddd,"12.4,9.9,2.6"
H,39,3.34,ddd,"9.9,9.4,8.6"
H,40,3.34,ddd,"11.3,9.4,2.6"
H,41,2.35,s,
H,42,2.35,s,
H,43,2.35,s,
H,44,3.78,dd,"10.2,4.8"
H,45,2.11,ddd,"13.0,12.4,4.8"
H,46,2.11,ddd,"12.4,10.2,4.2"
H,47,3.09,ddd,"13.0,4.2,3.5"
H,48,4.6,s,
H,49,4.6,s,
H,50,4.04,dd,"9.4,3.3"
H,51,4.04,dd,"10.8,9.4"
H,52,2.83,m,
H,53,3.54,d,1.5
