C,1,38.98,s,
N,2,,,
C,3,164.83,s,
O,4,,,
C,5,114.3,s,
C,6,132.53,s,
C,7,132.23,s,
C,8,14.31,s,
C,9,132.74,s,
C,10,40.4,s,
C,11,18.87,s,
C,12,,,
O,13,,,
C,14,135.55,s,
C,15,130.22,s,
C,16,110.64,s,
C,17,153.57,s,
N,18,,,
C,19,40.19,s,
C,20,40.19,s,
C,21,110.64,s,
C,22,130.22,s,
H,23,3.15,s,
H,24,3.15,s,
H,25,3.15,s,
H,26,,,
H,27,6.16,d,17.0
H,28,6.9,d,17.0
H,29,1.81,s,
H,30,1.81,s,
H,31,1.81,s,
H,32,5.92,d,7.0
H,33,2.83,dq,"7.0,6.9"
H,34,1.03,d,6.9
H,35,1.03,d,6.9
H,36,1.03,d,6.9
H,37,8.1,ddd,"7.5,1.9,0.5"
H,38,6.68,ddd,"7.5,2.4,0.5"
H,39,3.01,s,
H,40,3.01,s,
H,41,3.01,s,
H,42,3.01,s,
H,43,3.01,s,
H,44,3.01,s,
H,45,6.68,ddd,"6.5,2.4,0.5"
H,46,8.1,ddd,"6.5,1.9,0.5"
