C,1,56.0,s,
O,2,,,
C,3,150.0,s,
C,4,111.61,s,
C,5,122.3,s,
C,6,131.4,s,
C,7,110.67,s,
C,8,147.0,s,
O,9,,,
C,10,155.6,s,
C,11,120.41,s,
C,12,128.6,s,
C,13,130.9,s,
C,14,128.6,s,
C,15,120.41,s,
C,16,45.3,s,
C,17,166.2,s,
N,18,,,
C,19,43.8,s,
C,20,27.6,s,
C,21,135.3,s,
C,22,110.47,s,
C,23,147.88,s,
O,24,,,
C,25,56.25,s,
C,26,136.32,s,
O,27,,,
C,28,145.43,s,
C,29,108.29,s,
O,30,,,
C,31,147.0,s,
C,32,110.33,s,
C,33,130.4,s,
C,34,127.4,s,
C,35,111.48,s,
C,36,146.35,s,
O,37,,,
C,38,55.45,s,
C,39,24.9,s,
C,40,40.35,s,
N,41,,,
C,42,54.9,s,
C,43,42.2,s,
H,44,3.85,s,
H,45,3.85,s,
H,46,3.85,s,
H,47,6.82,dd,"8.8,0.5"
H,48,6.59,dd,"8.8,1.9"
H,49,4.49,dd,"1.9,0.5"
H,50,7.06,ddd,"22.7,1.9,0.5"
H,51,6.92,ddd,"22.7,1.9,0.5"
H,52,6.92,ddd,"24.3,1.9,0.5"
H,53,7.06,ddd,"24.3,1.9,0.5"
H,54,4.19,s,
H,55,4.19,s,
H,56,3.5,ddd,"12.4,10.0,8.9"
H,57,3.5,ddd,"12.4,9.0,0.6"
H,58,2.9,ddd,"15.4,8.9,0.6"
H,59,2.9,ddd,"15.4,10.0,9.0"
H,60,6.68,s,
H,61,3.84,s,
H,62,3.84,s,
H,63,3.84,s,
H,64,,,
H,65,6.64,d,0.5
H,66,6.55,d,0.5
H,67,3.8,s,
H,68,3.8,s,
H,69,3.8,s,
H,70,2.78,ddd,"15.4,10.3,9.1"
H,71,2.78,dd,"15.4,8.3"
H,72,3.08,ddd,"12.4,10.3,8.3"
H,73,3.08,dd,"12.4,9.1"
H,74,,,
H,75,4.13,dd,"12.5,2.1"
H,76,3.01,dd,"15.4,12.5"
H,77,3.01,dd,"15.4,2.1"
