C,1,56.13,s,
O,2,,,
C,3,148.44,s,
C,4,110.3,s,
C,5,127.1,s,
C,6,128.9,s,
C,7,125.49,s,
C,8,147.14,s,
O,9,,,
C,10,49.5,s,
N,11,,,
C,12,40.7,s,
C,13,57.1,s,
C,14,31.9,s,
C,15,134.2,s,
C,16,110.47,s,
C,17,147.78,s,
C,18,150.0,s,
C,19,109.55,s,
C,20,130.9,s,
C,21,193.0,s,
O,22,,,
C,23,45.7,s,
O,24,,,
C,25,101.24,s,
O,26,,,
H,27,3.88,s,
H,28,3.88,s,
H,29,3.88,s,
H,30,6.83,d,8.8
H,31,6.87,d,8.8
H,32,,,
H,33,4.25,s,
H,34,4.25,s,
H,35,2.4,s,
H,36,2.4,s,
H,37,2.4,s,
H,38,3.34,ddd,"12.4,11.5,1.9"
H,39,3.34,ddd,"12.4,5.2,3.0"
H,40,2.91,ddd,"15.4,3.0,1.9"
H,41,2.91,ddd,"15.4,11.5,5.2"
H,42,6.68,d,0.5
H,43,7.09,d,0.5
H,44,4.14,s,
H,45,4.14,s,
H,46,6.12,s,
H,47,6.12,s,
