C,1,23.49,s,
C,2,169.97,s,
O,3,,,
N,4,,,
C,5,95.6,s,
N,6,,,
C,7,171.16,s,
O,8,,,
C,9,61.74,s,
C,10,14.43,s,
C,11,14.43,s,
C,12,142.35,s,
C,13,116.11,s,
C,14,131.17,s,
C,15,122.35,s,
C,16,123.64,s,
C,17,130.97,s,
C,18,77.48,s,
C,19,41.07,s,
C,20,60.2,s,
N,21,,,
C,22,151.58,s,
N,23,,,
C,24,147.38,s,
C,25,125.9,s,
C,26,134.2,s,
C,27,127.98,s,
C,28,126.37,s,
C,29,120.75,s,
C,30,165.65,s,
O,31,,,
C,32,171.36,s,
O,33,,,
O,34,,,
H,35,2.19,s,
H,36,2.19,s,
H,37,2.19,s,
H,38,5.01,s,
H,39,1.86,ddd,"10.0,6.4,2.4"
H,40,1.86,ddd,"11.0,7.6,2.4"
H,41,1.86,ddd,"11.0,6.4,2.4"
H,42,1.86,ddd,"10.0,7.6,2.4"
H,43,7.32,ddd,"8.7,1.4,0.5"
H,44,7.43,ddd,"8.7,6.4,1.4"
H,45,6.87,ddd,"8.5,6.4,1.4"
H,46,7.48,ddd,"8.5,1.4,0.5"
H,47,2.49,dd,"12.4,9.0"
H,48,2.49,dd,"12.4,11.2"
H,49,4.45,dd,"11.2,9.0"
H,50,8.58,s,
H,51,7.48,ddd,"6.9,1.4,0.5"
H,52,7.51,ddd,"8.1,6.9,1.4"
H,53,7.48,ddd,"8.1,6.6,1.4"
H,54,8.23,ddd,"6.6,1.4,0.5"
