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,9,34.93,s,
C,10,61.74,s,
N,11,,,
C,12,149.2,s,
C,13,111.8,s,
C,14,127.0,s,
C,15,121.2,s,
C,16,123.1,s,
C,17,139.0,s,
C,18,58.4,s,
C,19,37.2,s,
C,20,51.33,s,
N,21,,,
C,22,44.92,s,
C,23,31.28,s,
C,24,78.41,s,
O,25,,,
C,26,57.07,s,
C,27,71.28,s,
H,28,3.14,s,
H,29,3.14,s,
H,30,3.14,s,
H,31,4.09,dd,"11.9,8.5"
H,32,2.04,dd,"12.4,11.9"
H,33,2.04,dd,"12.4,8.5"
H,34,1.72,ddd,"12.4,10.5,1.4"
H,35,1.72,dt,"12.4,10.3"
H,36,1.99,ddd,"12.4,10.3,1.4"
H,37,1.99,ddd,"12.4,10.5,10.3"
H,38,,,
H,39,7.15,ddd,"8.6,1.4,0.5"
H,40,7.22,ddd,"8.6,7.1,1.4"
H,41,6.94,ddd,"7.1,6.7,1.4"
H,42,7.25,ddd,"6.7,1.4,0.5"
H,43,2.18,ddd,"12.4,11.9,9.0"
H,44,2.18,ddd,"12.4,7.1,1.6"
H,45,3.11,ddd,"9.4,9.0,1.6"
H,46,3.11,ddd,"11.9,9.4,7.1"
H,47,2.78,ddd,"12.4,10.0,8.3"
H,48,2.78,ddd,"12.4,10.2,2.6"
H,49,1.71,m,
H,50,1.71,m,
H,51,4.77,dd,"12.0,5.1"
H,52,3.11,s,
H,53,3.11,s,
H,54,3.11,s,
H,55,2.67,s,
