C,1,51.88,s,
O,2,,,
C,3,168.2,s,
O,4,,,
C,5,128.32,s,
C,6,14.13,s,
C,7,126.29,s,
C,8,36.8,s,
C,9,57.7,s,
C,10,38.67,s,
C,11,52.3,s,
N,12,,,
C,13,37.0,s,
C,14,86.55,s,
N,15,,,
C,16,149.95,s,
C,17,109.1,s,
C,18,126.17,s,
C,19,118.95,s,
C,20,123.25,s,
C,21,135.2,s,
H,22,3.72,s,
H,23,3.72,s,
H,24,3.72,s,
H,25,1.93,s,
H,26,1.93,s,
H,27,1.93,s,
H,28,5.54,t,7.0
H,29,2.22,d,7.0
H,30,2.22,d,7.0
H,31,2.18,ddd,"12.4,9.6,2.1"
H,32,2.18,ddd,"12.4,11.5,8.0"
H,33,3.34,ddd,"11.5,9.4,2.1"
H,34,3.34,ddd,"9.6,9.4,8.0"
H,35,2.3,s,
H,36,2.3,s,
H,37,2.3,s,
H,38,5.27,s,
H,39,,,
H,40,6.7,ddd,"8.0,1.4,0.5"
H,41,7.1,ddd,"8.0,7.2,1.4"
H,42,6.94,ddd,"9.2,7.2,1.4"
H,43,7.25,ddd,"9.2,1.4,0.5"
