C,1,45.17,s,
N,2,,,
C,3,45.17,s,
C,4,59.9,s,
C,5,23.2,s,
C,6,116.6,s,
C,7,124.64,s,
N,8,,,
C,9,141.74,s,
C,10,147.17,s,
O,11,,,
C,12,114.66,s,
C,13,112.23,s,
C,14,137.2,s,
N,15,,,
C,16,132.7,s,
C,17,108.8,s,
C,18,126.45,s,
C,19,20.46,s,
C,20,52.0,s,
N,21,,,
C,22,45.3,s,
C,23,52.5,s,
C,24,137.91,s,
C,25,111.03,s,
C,26,124.83,s,
C,27,121.72,s,
C,28,118.88,s,
C,29,129.8,s,
H,30,2.33,s,
H,31,2.33,s,
H,32,2.33,s,
H,33,2.33,s,
H,34,2.33,s,
H,35,2.33,s,
H,36,3.34,t,6.6
H,37,3.34,t,6.6
H,38,2.88,t,6.6
H,39,2.88,t,6.6
H,40,7.54,d,0.5
H,41,,,
H,42,6.91,d,7.6
H,43,7.32,d,7.6
H,44,,,
H,45,2.78,ddd,"15.4,14.0,3.3"
H,46,2.78,dt,"15.4,4.3"
H,47,3.34,ddd,"14.0,12.4,4.3"
H,48,3.34,ddd,"12.4,4.3,3.3"
H,49,2.4,s,
H,50,2.4,s,
H,51,2.4,s,
H,52,4.05,s,
H,53,4.05,s,
H,54,7.53,ddd,"7.4,1.4,0.5"
H,55,7.36,ddd,"7.4,6.8,1.4"
H,56,7.21,ddd,"8.1,6.8,1.4"
H,57,7.54,ddt,"8.1,1.4,0.5"
