C,1,15.09,s,
C,2,35.19,s,
C,3,34.21,s,
C,4,83.2,s,
C,5,63.83,s,
C,6,29.71,s,
C,7,34.03,s,
C,8,92.26,s,
O,9,,,
C,10,74.82,s,
C,11,30.57,s,
C,12,35.22,s,
C,13,77.48,s,
C,14,37.71,s,
C,15,35.3,s,
C,16,15.47,s,
C,17,172.96,s,
O,18,,,
O,19,,,
C,20,55.9,s,
N,21,,,
O,22,,,
C,23,179.56,s,
O,24,,,
H,25,1.2,d,6.7
H,26,1.2,d,6.7
H,27,1.2,d,6.7
H,28,2.59,qdd,"6.7,6.1,0.6"
H,29,1.79,ddd,"12.4,11.1,6.1"
H,30,1.79,ddd,"12.4,6.6,0.6"
H,31,4.18,ddd,"11.1,6.6,4.9"
H,32,3.41,ddd,"11.4,5.5,4.9"
H,33,1.84,m,
H,34,1.84,m,
H,35,2.1,ddd,"12.4,12.2,9.2"
H,36,2.1,ddd,"12.4,6.4,0.6"
H,37,5.15,m,
H,38,1.8,m,
H,39,1.8,m,
H,40,1.9,ddd,"14.1,12.4,4.6"
H,41,1.9,ddd,"12.4,3.7,2.6"
H,42,1.96,dd,"12.4,10.2"
H,43,1.96,dd,"12.4,2.3"
H,44,2.41,dqd,"10.2,6.7,2.3"
H,45,1.17,d,6.7
H,46,1.17,d,6.7
H,47,1.17,d,6.7
H,48,3.69,dd,"9.4,5.8"
H,49,3.69,dd,"9.4,0.4"
