C,1,12.72,s,
C,2,118.86,s,
C,3,140.39,s,
C,4,51.67,s,
N,5,,,
C,6,49.76,s,
C,7,38.94,s,
C,8,41.86,s,
C,9,142.6,s,
C,10,127.9,s,
C,11,186.54,s,
O,12,,,
C,13,125.71,s,
C,14,125.38,s,
C,15,171.25,s,
N,16,,,
C,17,87.49,s,
C,18,36.32,s,
C,19,28.16,s,
C,20,42.38,s,
C,21,52.6,s,
C,22,172.89,s,
O,23,,,
O,24,,,
C,25,51.46,s,
H,26,1.67,d,7.0
H,27,1.67,d,7.0
H,28,1.67,d,7.0
H,29,5.45,q,7.0
H,30,3.82,s,
H,31,3.82,s,
H,32,3.34,ddd,"9.4,8.5,0.5"
H,33,3.34,ddd,"12.1,9.4,7.5"
H,34,2.18,ddd,"12.4,12.1,8.5"
H,35,2.18,ddd,"12.4,7.5,0.5"
H,36,6.22,s,
H,37,6.28,d,11.9
H,38,6.97,d,11.9
H,39,2.05,ddd,"12.4,11.4,3.1"
H,40,2.05,ddd,"12.4,11.6,5.9"
H,41,1.58,m,
H,42,1.58,m,
H,43,2.99,ddd,"6.9,2.5,1.6"
H,44,3.08,d,2.5
H,45,3.7,s,
H,46,3.7,s,
H,47,3.7,s,
