C,1,55.43,s,
O,2,,,
C,3,157.93,s,
C,4,111.3,s,
C,5,154.7,s,
C,6,192.3,s,
O,7,,,
N,8,,,
C,9,157.1,s,
C,10,156.2,s,
C,11,122.1,s,
C,12,136.77,s,
C,13,123.4,s,
C,14,149.0,s,
N,15,,,
C,16,107.67,s,
H,17,3.76,s,
H,18,3.76,s,
H,19,3.76,s,
H,20,7.57,d,1.9
H,21,10.13,s,
H,22,8.25,ddd,"7.0,1.4,0.5"
H,23,7.75,ddd,"8.2,7.0,1.4"
H,24,7.27,ddd,"8.2,4.8,1.4"
H,25,8.6,dd,"4.8,1.4"
H,26,7.57,dd,"1.9,0.5"
