C,1,21.69,s,
C,2,131.18,s,
C,3,21.69,s,
C,4,124.79,s,
C,5,23.74,s,
C,6,35.28,s,
C,7,41.86,s,
C,8,23.79,s,
C,9,142.69,s,
C,10,132.07,s,
C,11,128.5,s,
C,12,185.0,s,
O,13,,,
C,14,140.33,s,
C,15,102.9,s,
C,16,143.45,s,
N,17,,,
C,18,136.33,s,
C,19,111.1,s,
C,20,122.04,s,
C,21,120.07,s,
C,22,119.63,s,
C,23,126.19,s,
C,24,73.63,s,
O,25,,,
C,26,72.44,s,
H,27,1.63,s,
H,28,1.63,s,
H,29,1.63,s,
H,30,1.63,s,
H,31,1.63,s,
H,32,1.63,s,
H,33,5.11,t,7.0
H,34,2.11,dt,"7.0,6.9"
H,35,2.11,dt,"7.0,6.9"
H,36,1.72,t,6.9
H,37,1.72,t,6.9
H,38,1.13,s,
H,39,1.13,s,
H,40,1.13,s,
H,41,5.99,s,
H,42,10.11,s,
H,43,7.55,s,
H,44,,,
H,45,7.35,ddd,"7.3,1.4,0.5"
H,46,7.18,ddd,"7.3,7.1,1.4"
H,47,7.08,ddd,"8.5,7.1,1.4"
H,48,7.41,ddd,"8.5,1.4,0.5"
H,49,4.52,s,
H,50,4.13,s,
H,51,4.13,s,
