C,1,18.87,s,
C,2,40.4,s,
C,3,81.41,s,
O,4,,,
S,5,,,
O,6,,,
O,7,,,
O,8,,,
C,9,36.08,s,
C,10,59.99,s,
C,11,31.77,s,
C,12,57.53,s,
C,13,43.75,s,
C,14,157.99,s,
N,15,,,
C,16,158.66,s,
O,17,,,
N,18,,,
C,19,178.12,s,
O,20,,,
C,21,41.95,s,
N,22,,,
C,23,154.56,s,
N,24,,,
C,25,47.14,s,
C,26,57.53,s,
N,27,,,
H,28,1.03,d,6.6
H,29,1.03,d,6.6
H,30,1.03,d,6.6
H,31,2.83,qdd,"6.6,5.2,3.4"
H,32,4.57,ddd,"10.9,5.6,5.2"
H,33,,,
H,34,2.2,ddd,"12.4,5.6,2.6"
H,35,2.2,ddd,"12.4,10.9,9.7"
H,36,3.73,m,
H,37,2.58,ddd,"12.4,5.1,1.7"
H,38,2.58,ddd,"12.4,11.6,5.3"
H,39,4.28,tdd,"6.0,5.3,1.7"
H,40,3.41,d,6.0
H,41,3.41,d,6.0
H,42,,,
H,43,3.67,s,
H,44,3.67,s,
H,45,,,
H,46,2.89,dd,"12.4,8.9"
H,47,2.89,dd,"12.4,7.4"
H,48,3.14,ddd,"8.9,7.4,3.4"
