C,1,14.45,s,
C,2,44.3,s,
C,3,31.1,s,
C,4,49.76,s,
N,5,,,
C,6,49.05,s,
C,7,61.74,s,
C,8,39.41,s,
C,9,108.8,s,
C,10,140.19,s,
N,11,,,
C,12,134.7,s,
C,13,110.2,s,
C,14,121.3,s,
C,15,119.33,s,
C,16,118.35,s,
C,17,127.08,s,
C,18,34.4,s,
C,19,24.4,s,
C,20,24.4,s,
C,21,40.4,s,
C,22,42.19,s,
C,23,61.74,s,
C,24,174.39,s,
O,25,,,
N,26,,,
H,27,1.2,d,6.6
H,28,1.2,d,6.6
H,29,1.2,d,6.6
H,30,2.69,qdd,"6.6,6.5,0.8"
H,31,1.8,m,
H,32,1.8,m,
H,33,3.34,ddd,"9.4,8.8,1.1"
H,34,3.34,ddd,"10.6,10.0,9.4"
H,35,3.01,s,
H,36,3.01,s,
H,37,3.53,s,
H,38,3.53,s,
H,39,,,
H,40,7.35,ddd,"8.9,1.4,0.5"
H,41,7.18,ddd,"8.9,7.4,1.4"
H,42,7.13,ddd,"7.4,6.3,1.4"
H,43,7.52,ddd,"6.3,1.4,0.5"
H,44,1.13,s,
H,45,1.13,s,
H,46,1.13,s,
H,47,1.13,s,
H,48,1.13,s,
H,49,1.13,s,
H,50,2.83,dd,"12.8,7.5"
H,51,2.02,dd,"12.8,12.4"
H,52,2.02,dd,"12.4,7.5"
H,53,7.59,s,
