C,1,55.2,s,
O,2,,,
C,3,144.7,s,
C,4,110.12,s,
C,5,138.43,s,
C,6,128.38,s,
C,7,114.5,s,
C,8,145.0,s,
O,9,,,
C,10,30.55,s,
C,11,40.6,s,
N,12,,,
C,13,46.6,s,
C,14,27.4,s,
C,15,147.5,s,
C,16,127.9,s,
C,17,197.79,s,
O,18,,,
C,19,78.42,s,
O,20,,,
C,21,57.6,s,
C,22,43.68,s,
C,23,63.9,s,
H,24,3.86,s,
H,25,3.86,s,
H,26,3.86,s,
H,27,6.47,d,0.5
H,28,6.63,d,0.5
H,29,,,
H,30,2.9,ddd,"15.4,13.2,4.7"
H,31,2.9,ddd,"15.4,5.3,2.1"
H,32,3.39,ddd,"13.2,12.4,5.3"
H,33,3.39,ddd,"12.4,4.7,2.1"
H,34,2.89,ddd,"11.5,9.4,7.8"
H,35,2.89,ddd,"9.4,8.6,0.8"
H,36,2.47,ddd,"12.4,7.8,0.8"
H,37,2.47,ddd,"12.4,11.5,8.6"
H,38,6.22,s,
H,39,4.87,dd,"11.7,0.7"
H,40,3.42,s,
H,41,3.42,s,
H,42,3.42,s,
H,43,2.42,dd,"12.4,11.7"
H,44,2.42,dd,"12.4,0.7"
