C,1,42.3,s,
N,2,,,
C,3,52.3,s,
C,4,29.4,s,
C,5,40.92,s,
C,6,135.4,s,
C,7,123.2,s,
C,8,124.3,s,
C,9,131.17,s,
C,10,116.11,s,
C,11,142.35,s,
N,12,,,
C,13,75.9,s,
O,14,,,
C,15,40.24,s,
C,16,35.5,s,
C,17,129.97,s,
C,18,124.26,s,
C,19,70.2,s,
O,20,,,
C,21,166.77,s,
O,22,,,
C,23,24.51,s,
C,24,56.75,s,
C,25,57.53,s,
H,26,2.35,s,
H,27,2.35,s,
H,28,2.35,s,
H,29,3.34,ddd,"12.4,8.4,1.5"
H,30,3.34,ddd,"12.4,10.6,8.0"
H,31,1.8,m,
H,32,1.8,m,
H,33,3.38,ddd,"10.6,9.2,8.4"
H,34,7.6,ddd,"8.0,1.4,0.5"
H,35,6.88,ddd,"8.0,7.8,1.4"
H,36,7.43,ddd,"8.0,7.8,1.4"
H,37,7.32,ddd,"8.0,1.4,0.5"
H,38,5.68,dd,"11.3,2.9"
H,39,,,
H,40,2.23,ddd,"12.4,11.3,11.2"
H,41,2.23,ddd,"12.4,3.6,2.9"
H,42,3.23,m,
H,43,7.21,dd,"3.6,3.5"
H,44,4.86,dd,"17.4,3.5"
H,45,4.86,dd,"17.4,3.6"
H,46,2.11,ddd,"12.4,2.8,1.1"
H,47,2.11,ddd,"12.6,12.4,8.9"
H,48,2.3,ddd,"9.5,8.9,1.1"
H,49,4.28,dd,"10.6,9.5"
