C,1,31.45,s,
N,2,,,
C,3,165.65,s,
O,4,,,
C,5,126.8,s,
C,6,130.55,s,
C,7,125.35,s,
C,8,132.76,s,
C,9,124.0,s,
C,10,145.91,s,
N,11,,,
C,12,162.36,s,
O,13,,,
C,14,57.53,s,
C,15,35.29,s,
C,16,110.16,s,
C,17,123.99,s,
N,18,,,
C,19,136.38,s,
C,20,111.5,s,
C,21,121.51,s,
C,22,119.23,s,
C,23,118.5,s,
C,24,127.47,s,
H,25,2.91,s,
H,26,2.91,s,
H,27,2.91,s,
H,28,8.1,ddd,"6.9,1.4,0.5"
H,29,7.41,ddd,"8.0,6.9,1.4"
H,30,7.51,ddd,"8.0,6.7,1.4"
H,31,7.48,ddd,"6.7,1.4,0.5"
H,32,,,
H,33,4.28,t,6.6
H,34,3.01,d,6.6
H,35,3.01,d,6.6
H,36,7.11,d,0.5
H,37,,,
H,38,7.34,ddd,"7.2,1.4,0.5"
H,39,7.14,ddd,"7.2,7.0,1.4"
H,40,7.01,td,"7.0,1.4"
H,41,7.57,ddt,"7.0,1.4,0.5"
