C,1,18.59,s,
C,2,50.97,s,
N,3,,,
C,4,169.5,s,
O,5,,,
N,6,,,
C,7,31.45,s,
C,8,55.57,s,
C,9,13.17,s,
C,10,57.53,s,
N,11,,,
C,12,173.18,s,
O,13,,,
C,14,49.47,s,
C,15,17.44,s,
N,16,,,
C,17,153.2,s,
O,18,,,
N,19,,,
C,20,54.73,s,
C,21,28.15,s,
C,22,110.64,s,
C,23,123.96,s,
N,24,,,
C,25,136.71,s,
C,26,111.5,s,
C,27,121.51,s,
C,28,119.23,s,
C,29,118.93,s,
C,30,127.9,s,
C,31,174.85,s,
O,32,,,
O,33,,,
C,34,171.19,s,
O,35,,,
N,36,,,
C,37,117.43,s,
C,38,157.83,s,
C,39,39.29,s,
C,40,73.63,s,
O,41,,,
C,42,89.68,s,
N,43,,,
C,44,140.75,s,
C,45,102.23,s,
C,46,164.21,s,
O,47,,,
N,48,,,
C,49,151.01,s,
O,50,,,
O,51,,,
H,52,1.49,d,6.6
H,53,1.49,d,6.6
H,54,1.49,d,6.6
H,55,4.09,q,6.6
H,56,,,
H,57,,,
H,58,2.91,s,
H,59,2.91,s,
H,60,2.91,s,
H,61,3.95,qd,"6.7,5.7"
H,62,0.89,d,6.7
H,63,0.89,d,6.7
H,64,0.89,d,6.7
H,65,4.58,dd,"7.0,5.7"
H,66,7.4,d,7.0
H,67,4.17,dq,"7.0,6.6"
H,68,1.23,d,6.6
H,69,1.23,d,6.6
H,70,1.23,d,6.6
H,71,6.43,d,7.0
H,72,6.43,d,7.0
H,73,4.35,dt,"7.0,6.3"
H,74,3.19,d,6.3
H,75,3.19,d,6.3
H,76,7.25,d,0.5
H,77,,,
H,78,7.34,ddd,"7.8,1.4,0.5"
H,79,7.14,ddd,"7.8,6.9,1.4"
H,80,7.01,ddd,"7.0,6.9,1.4"
H,81,7.57,ddt,"7.0,1.4,0.5"
H,82,,,
H,83,7.97,d,7.0
H,84,7.52,d,7.0
H,85,2.54,dd,"12.4,1.4"
H,86,2.54,dd,"12.4,7.2"
H,87,4.52,ddd,"7.2,6.6,1.4"
H,88,,,
H,89,5.86,d,6.6
H,90,7.5,d,4.2
H,91,5.59,d,4.2
H,92,,,
