C,1,21.01,s,
C,2,170.9,s,
O,3,,,
O,4,,,
C,5,61.37,s,
C,6,127.45,s,
C,7,140.39,s,
C,8,52.94,s,
N,9,,,
C,10,51.95,s,
C,11,46.0,s,
C,12,59.2,s,
C,13,167.21,s,
C,14,132.07,s,
C,15,190.29,s,
O,16,,,
C,17,38.0,s,
C,18,26.8,s,
C,19,64.27,s,
N,20,,,
C,21,144.53,s,
C,22,110.57,s,
C,23,128.5,s,
C,24,121.8,s,
C,25,121.9,s,
C,26,138.17,s,
H,27,2.07,s,
H,28,2.07,s,
H,29,2.07,s,
H,30,4.61,d,7.0
H,31,4.61,d,7.0
H,32,5.88,t,7.0
H,33,3.31,s,
H,34,3.31,s,
H,35,3.04,ddd,"9.4,8.3,1.4"
H,36,3.04,ddd,"11.3,9.4,7.3"
H,37,2.16,ddd,"12.4,7.3,1.4"
H,38,2.16,ddd,"12.4,11.3,8.3"
H,39,9.84,s,
H,40,4.09,dd,"4.6,2.8"
H,41,1.85,ddd,"12.4,4.6,2.1"
H,42,1.85,ddd,"12.4,4.1,2.8"
H,43,3.78,dd,"4.1,2.1"
H,44,,,
H,45,6.85,ddd,"7.4,1.4,0.5"
H,46,7.13,ddd,"7.4,7.3,1.4"
H,47,6.86,ddd,"7.3,7.0,1.4"
H,48,7.22,ddd,"7.0,1.4,0.5"
