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,9,23.44,s,
C,10,66.54,s,
N,11,,,
O,12,,,
C,13,66.54,s,
C,14,36.49,s,
C,15,41.86,s,
C,16,134.28,s,
C,17,124.58,s,
C,18,122.44,s,
C,19,127.0,s,
C,20,111.8,s,
C,21,149.2,s,
N,22,,,
C,23,61.74,s,
C,24,34.93,s,
C,25,35.28,s,
C,26,71.6,s,
H,27,3.14,s,
H,28,3.14,s,
H,29,3.14,s,
H,30,4.09,dd,"11.2,3.8"
H,31,2.04,dd,"12.4,3.8"
H,32,2.04,dd,"12.4,11.2"
H,33,1.72,ddd,"13.9,12.4,4.6"
H,34,1.72,ddd,"12.4,3.2,2.3"
H,35,1.88,m,
H,36,1.88,m,
H,37,3.65,ddd,"12.4,5.4,2.1"
H,38,3.65,ddd,"12.4,11.3,1.0"
H,39,3.65,ddd,"11.2,9.4,1.9"
H,40,3.65,ddd,"10.0,9.4,6.9"
H,41,2.37,ddd,"12.4,10.0,1.9"
H,42,2.37,ddd,"12.4,11.2,6.9"
H,43,7.25,ddd,"9.8,1.4,0.5"
H,44,6.94,ddd,"9.8,8.1,1.4"
H,45,7.22,ddd,"8.1,6.7,1.4"
H,46,7.15,ddd,"6.7,1.4,0.5"
H,47,,,
H,48,1.99,ddd,"12.4,9.5,1.0"
H,49,1.99,ddd,"12.4,10.8,8.2"
H,50,1.72,ddd,"12.4,10.8,1.0"
H,51,1.72,ddd,"12.4,9.5,8.2"
H,52,4.86,s,
