C,1,20.1,s,
C,2,27.6,s,
C,3,20.1,s,
C,4,46.61,s,
C,5,172.96,s,
O,6,,,
O,7,,,
C,8,74.77,s,
C,9,34.43,s,
C,10,53.65,s,
N,11,,,
C,12,62.9,s,
C,13,128.4,s,
C,14,131.7,s,
C,15,62.66,s,
O,16,,,
C,17,179.2,s,
O,18,,,
C,19,74.35,s,
C,20,25.14,s,
O,21,,,
C,22,43.3,s,
C,23,18.6,s,
C,24,75.5,s,
H,25,0.88,d,6.4
H,26,0.88,d,6.4
H,27,0.88,d,6.4
H,28,1.87,m,"6.4,5.6"
H,29,0.88,d,6.4
H,30,0.88,d,6.4
H,31,0.88,d,6.4
H,32,2.82,dd,"5.6,4.6"
H,33,5.43,ddd,"11.6,3.8,3.3"
H,34,2.03,m,
H,35,2.03,m,
H,36,3.16,ddd,"9.4,7.4,0.6"
H,37,3.16,ddd,"12.8,9.4,6.7"
H,38,3.72,dd,"9.4,4.5"
H,39,3.72,dd,"9.4,3.0"
H,40,5.99,dd,"4.5,3.0"
H,41,4.63,s,
H,42,4.63,s,
H,43,1.47,s,
H,44,1.47,s,
H,45,1.47,s,
H,46,,,
H,47,1.98,qd,"6.7,4.6"
H,48,1.05,d,6.7
H,49,1.05,d,6.7
H,50,1.05,d,6.7
H,51,4.38,d,3.3
