C,1,28.26,s,
C,2,35.67,s,
C,3,28.26,s,
C,4,40.17,s,
C,5,19.16,s,
C,6,30.64,s,
C,7,140.91,s,
C,8,143.15,s,
C,9,22.63,s,
C,10,35.28,s,
C,11,41.8,s,
C,12,20.8,s,
C,13,36.62,s,
C,14,59.35,s,
O,15,,,
C,16,42.24,s,
H,17,1.3,s,
H,18,1.3,s,
H,19,1.3,s,
H,20,1.3,s,
H,21,1.3,s,
H,22,1.3,s,
H,23,1.57,ddd,"13.4,12.4,3.2"
H,24,1.57,ddd,"12.4,4.1,2.0"
H,25,1.63,m,
H,26,1.63,m,
H,27,3.17,ddd,"15.4,13.8,3.6"
H,28,3.17,ddd,"15.4,4.3,3.6"
H,29,2.37,ddd,"15.4,4.9,4.3"
H,30,2.37,ddd,"15.4,14.4,3.0"
H,31,1.72,ddd,"12.4,4.9,3.0"
H,32,1.72,ddd,"14.4,12.4,4.3"
H,33,1.13,s,
H,34,1.13,s,
H,35,1.13,s,
H,36,2.19,t,6.4
H,37,2.19,t,6.4
H,38,3.69,t,6.4
H,39,3.69,t,6.4
H,40,,,
H,41,2.43,s,
H,42,2.43,s,
