C,1,12.72,s,
C,2,118.86,s,
C,3,140.39,s,
C,4,52.94,s,
N,5,,,
C,6,51.95,s,
C,7,46.0,s,
C,8,59.2,s,
C,9,167.8,s,
C,10,105.26,s,
C,11,166.58,s,
O,12,,,
O,13,,,
C,14,51.57,s,
C,15,38.0,s,
C,16,26.8,s,
C,17,64.27,s,
N,18,,,
C,19,133.41,s,
C,20,137.8,s,
O,21,,,
C,22,114.57,s,
C,23,128.5,s,
C,24,113.3,s,
C,25,136.2,s,
H,26,1.67,d,7.0
H,27,1.67,d,7.0
H,28,1.67,d,7.0
H,29,5.45,q,7.0
H,30,3.31,s,
H,31,3.31,s,
H,32,3.04,ddd,"11.8,9.4,4.7"
H,33,3.04,ddd,"11.5,9.4,5.2"
H,34,2.16,ddd,"12.4,11.5,4.7"
H,35,2.16,ddd,"12.4,11.8,5.2"
H,36,3.61,s,
H,37,3.61,s,
H,38,3.61,s,
H,39,4.09,dd,"2.8,2.2"
H,40,1.85,ddd,"12.4,2.2,1.5"
H,41,1.85,ddd,"12.4,2.8,2.7"
H,42,3.78,dd,"2.7,1.5"
H,43,,,
H,44,,,
H,45,6.95,dd,"8.4,1.4"
H,46,7.3,dd,"8.4,6.6"
H,47,6.86,dd,"6.6,1.4"
