C,1,11.8,s,
C,2,48.0,s,
C,3,42.9,s,
C,4,34.1,s,
C,5,26.26,s,
C,6,57.08,s,
C,7,37.2,s,
C,8,29.88,s,
C,9,28.51,s,
C,10,43.47,s,
C,11,42.19,s,
C,12,64.18,s,
C,13,34.93,s,
C,14,35.28,s,
C,15,35.6,s,
C,16,19.24,s,
C,17,49.11,s,
C,18,21.64,s,
C,19,38.07,s,
C,20,37.91,s,
C,21,16.96,s,
C,22,138.43,s,
C,23,121.5,s,
C,24,127.0,s,
C,25,132.53,s,
C,26,124.03,s,
C,27,130.92,s,
C,28,165.65,s,
O,29,,,
N,30,,,
C,31,37.35,s,
N,32,,,
C,33,40.0,s,
C,34,40.0,s,
H,35,1.25,d,6.3
H,36,1.25,d,6.3
H,37,1.25,d,6.3
H,38,3.34,qd,"6.3,5.3"
H,39,1.94,ddd,"12.6,7.6,5.3"
H,40,1.58,m,
H,41,1.58,m,
H,42,1.48,m,
H,43,1.48,m,
H,44,1.16,ddd,"10.4,9.7,7.9"
H,45,1.86,m,
H,46,1.58,m,
H,47,1.58,m,
H,48,1.48,m,
H,49,1.48,m,
H,50,1.44,m,
H,51,2.02,dd,"12.4,8.4"
H,52,2.02,dd,"12.4,2.0"
H,53,1.99,ddd,"12.4,9.2,1.8"
H,54,1.99,dt,"12.4,9.1"
H,55,1.72,ddd,"12.4,9.1,1.8"
H,56,1.72,ddd,"12.4,9.2,9.1"
H,57,0.88,s,
H,58,0.88,s,
H,59,0.88,s,
H,60,0.83,ddd,"12.5,11.1,2.1"
H,61,1.46,m,
H,62,1.46,m,
H,63,1.17,ddd,"13.0,12.4,5.9"
H,64,1.17,ddd,"12.4,6.2,2.9"
H,65,0.94,s,
H,66,0.94,s,
H,67,0.94,s,
H,68,7.56,ddd,"7.2,1.4,0.5"
H,69,7.35,td,"7.2,1.4"
H,70,7.73,ddd,"7.3,7.2,1.4"
H,71,7.87,ddd,"7.3,1.4,0.5"
H,72,3.27,s,
H,73,3.27,s,
H,74,3.27,s,
H,75,2.38,s,
H,76,2.38,s,
H,77,2.38,s,
H,78,2.38,s,
H,79,2.38,s,
H,80,2.38,s,
