C,1,29.95,s,
C,2,,,
O,3,,,
C,4,43.37,s,
C,5,38.9,s,
C,6,36.24,s,
C,7,57.96,s,
C,8,133.78,s,
C,9,108.8,s,
C,10,128.61,s,
C,11,118.19,s,
C,12,121.23,s,
C,13,121.43,s,
C,14,109.13,s,
C,15,136.35,s,
N,16,,,
C,17,30.73,s,
C,18,27.4,s,
C,19,62.1,s,
C,20,38.77,s,
C,21,64.03,s,
O,22,,,
N,23,,,
C,24,36.91,s,
H,25,2.14,s,
H,26,2.14,s,
H,27,2.14,s,
H,28,2.74,d,6.2
H,29,2.74,d,6.2
H,30,2.75,m,
H,31,1.87,ddd,"12.6,12.4,5.6"
H,32,1.87,ddd,"12.4,9.9,5.4"
H,33,5.19,dd,"9.9,5.6"
H,34,7.5,ddd,"7.1,1.4,0.5"
H,35,7.2,ddd,"8.3,7.1,1.4"
H,36,7.97,ddd,"8.3,7.9,1.4"
H,37,7.18,ddd,"7.9,1.4,0.5"
H,38,3.38,s,
H,39,3.38,s,
H,40,3.38,s,
H,41,3.21,dd,"15.4,3.0"
H,42,3.21,dd,"15.4,10.5"
H,43,3.6,ddd,"10.5,6.6,3.0"
H,44,2.27,ddt,"9.1,6.6,5.8"
H,45,3.92,d,5.8
H,46,3.92,d,5.8
H,47,,,
H,48,2.52,s,
H,49,2.52,s,
H,50,2.52,s,
