O,1,,,
C,2,172.36,s,
C,3,31.48,s,
C,4,17.64,s,
C,5,49.76,s,
N,6,,,
C,7,71.25,s,
N,8,,,
C,9,57.7,s,
C,10,27.8,s,
C,11,25.7,s,
C,12,35.1,s,
C,13,58.0,s,
C,14,151.2,s,
C,15,104.6,s,
C,16,139.43,s,
C,17,116.63,s,
C,18,163.97,s,
O,19,,,
N,20,,,
C,21,50.0,s,
H,22,2.42,ddd,"18.4,7.9,0.7"
H,23,2.42,ddd,"18.4,12.9,7.6"
H,24,2.05,m,
H,25,2.05,m,
H,26,3.34,ddd,"12.4,3.6,1.0"
H,27,3.34,ddd,"14.1,12.4,4.6"
H,28,4.06,s,
H,29,4.06,s,
H,30,3.31,dd,"12.4,10.0"
H,31,3.31,dd,"12.4,4.6"
H,32,2.34,m,
H,33,1.95,dt,"12.4,3.4"
H,34,1.95,ddd,"12.4,3.6,2.2"
H,35,2.91,m,
H,36,3.31,dd,"12.4,8.6"
H,37,3.31,dd,"12.4,8.4"
H,38,6.0,dd,"6.2,1.4"
H,39,7.3,dd,"8.2,6.2"
H,40,6.39,dd,"8.2,1.4"
H,41,3.97,dd,"12.4,10.0"
H,42,3.97,dd,"12.4,0.7"
