C,1,19.29,s,
C,2,31.17,s,
C,3,53.83,s,
N,4,,,
C,5,49.05,s,
C,6,61.74,s,
C,7,39.41,s,
C,8,108.8,s,
C,9,140.19,s,
N,10,,,
C,11,134.7,s,
C,12,110.2,s,
C,13,121.3,s,
C,14,119.33,s,
C,15,118.35,s,
C,16,127.08,s,
C,17,34.4,s,
C,18,24.4,s,
C,19,24.4,s,
C,20,49.74,s,
C,21,42.19,s,
C,22,61.74,s,
C,23,42.19,s,
C,24,162.36,s,
O,25,,,
N,26,,,
H,27,0.9,d,6.4
H,28,0.9,d,6.4
H,29,0.9,d,6.4
H,30,2.13,m,
H,31,3.31,dd,"9.4,4.1"
H,32,3.31,dd,"9.5,9.4"
H,33,3.01,s,
H,34,3.01,s,
H,35,3.53,s,
H,36,3.53,s,
H,37,,,
H,38,7.35,ddd,"8.3,1.4,0.5"
H,39,7.18,ddd,"8.3,7.9,1.4"
H,40,7.13,ddd,"7.9,7.1,1.4"
H,41,7.52,ddd,"7.1,1.4,0.5"
H,42,1.13,s,
H,43,1.13,s,
H,44,1.13,s,
H,45,1.13,s,
H,46,1.13,s,
H,47,1.13,s,
H,48,2.41,t,10.1
H,49,2.02,dd,"12.4,10.1"
H,50,2.02,dd,"12.4,10.1"
H,51,2.02,dd,"12.4,10.3"
H,52,2.02,dd,"12.4,6.5"
H,53,,,
