C,1,52.9,s,
O,2,,,
C,3,165.81,s,
O,4,,,
C,5,144.85,s,
C,6,119.5,s,
C,7,138.43,s,
C,8,129.44,s,
C,9,145.72,s,
N,10,,,
C,11,19.7,s,
C,12,40.6,s,
N,13,,,
C,14,50.97,s,
C,15,125.17,s,
C,16,132.07,s,
C,17,132.53,s,
C,18,139.4,s,
C,19,74.32,s,
O,20,,,
C,21,56.13,s,
C,22,43.68,s,
C,23,61.74,s,
H,24,4.03,s,
H,25,4.03,s,
H,26,4.03,s,
H,27,7.17,d,0.5
H,28,8.69,d,0.5
H,29,2.9,ddd,"15.4,5.2,1.5"
H,30,2.9,ddd,"15.4,12.6,5.3"
H,31,3.39,ddd,"12.4,5.3,1.5"
H,32,3.39,ddd,"12.6,12.4,5.2"
H,33,4.04,dd,"9.4,4.7"
H,34,4.04,dd,"9.4,2.6"
H,35,5.85,dd,"4.7,2.6"
H,36,6.9,d,11.3
H,37,6.14,dd,"11.3,5.6"
H,38,5.19,ddd,"8.5,5.6,1.2"
H,39,3.15,s,
H,40,3.15,s,
H,41,3.15,s,
H,42,2.42,dd,"12.4,1.2"
H,43,2.42,dd,"12.4,8.5"
