C,1,52.0,s,
O,2,,,
C,3,171.25,s,
O,4,,,
C,5,46.85,s,
C,6,42.11,s,
C,7,41.86,s,
C,8,35.28,s,
C,9,20.97,s,
C,10,53.05,s,
N,11,,,
C,12,51.33,s,
C,13,37.2,s,
C,14,58.4,s,
C,15,139.0,s,
C,16,123.1,s,
C,17,121.2,s,
C,18,127.0,s,
C,19,111.8,s,
C,20,149.2,s,
N,21,,,
C,22,61.74,s,
C,23,43.68,s,
C,24,75.84,s,
O,25,,,
C,26,71.28,s,
H,27,3.14,s,
H,28,3.14,s,
H,29,3.14,s,
H,30,4.09,dd,"10.5,8.1"
H,31,2.04,dd,"12.4,8.1"
H,32,2.04,dd,"12.4,10.5"
H,33,1.72,ddd,"12.5,12.4,6.5"
H,34,1.72,ddd,"12.4,5.8,2.5"
H,35,1.61,m,
H,36,1.61,m,
H,37,2.81,ddd,"12.4,8.0,1.4"
H,38,2.81,ddd,"12.4,9.6,8.0"
H,39,3.11,ddd,"10.1,9.4,0.4"
H,40,3.11,ddd,"9.8,9.4,7.2"
H,41,2.18,ddd,"12.4,7.2,0.4"
H,42,2.18,ddd,"12.4,10.1,9.8"
H,43,7.25,ddd,"8.0,1.4,0.5"
H,44,6.94,ddd,"8.0,7.6,1.4"
H,45,7.22,ddd,"8.6,7.6,1.4"
H,46,7.15,ddd,"8.6,1.4,0.5"
H,47,,,
H,48,2.42,dd,"12.4,1.6"
H,49,2.42,dd,"12.4,9.9"
H,50,4.12,dd,"9.9,1.6"
H,51,,,
H,52,2.67,s,
