C,1,22.58,s,
C,2,23.87,s,
C,3,22.58,s,
C,4,48.43,s,
C,5,,,
O,6,,,
C,7,73.63,s,
C,8,36.38,s,
C,9,111.29,s,
C,10,123.67,s,
N,11,,,
C,12,136.35,s,
C,13,111.36,s,
C,14,121.51,s,
C,15,119.04,s,
C,16,118.62,s,
C,17,127.33,s,
O,18,,,
C,19,169.15,s,
O,20,,,
C,21,111.32,s,
C,22,131.16,s,
C,23,116.77,s,
C,24,133.74,s,
C,25,115.37,s,
C,26,150.7,s,
N,27,,,
H,28,0.92,d,6.4
H,29,0.92,d,6.4
H,30,0.92,d,6.4
H,31,2.16,m,"6.4,6.0"
H,32,0.92,d,6.4
H,33,0.92,d,6.4
H,34,0.92,d,6.4
H,35,2.74,d,6.0
H,36,2.74,d,6.0
H,37,4.4,t,6.0
H,38,3.53,d,6.0
H,39,3.53,d,6.0
H,40,7.12,d,0.5
H,41,,,
H,42,7.34,ddd,"6.3,1.4,0.5"
H,43,7.14,ddd,"8.1,6.3,1.4"
H,44,7.01,ddd,"8.1,8.0,1.4"
H,45,7.57,ddt,"8.0,1.4,0.5"
H,46,7.37,ddd,"8.8,1.4,0.5"
H,47,6.5,ddd,"8.8,8.4,1.4"
H,48,7.16,ddd,"8.4,6.5,1.4"
H,49,6.88,ddd,"6.5,1.4,0.5"
H,50,,,
H,51,,,
