C,1,15.61,s,
C,2,139.01,s,
C,3,127.36,s,
C,4,18.81,s,
C,5,167.45,s,
O,6,,,
O,7,,,
C,8,81.22,s,
C,9,130.07,s,
C,10,140.16,s,
C,11,18.2,s,
C,12,31.9,s,
C,13,32.2,s,
C,14,82.97,s,
O,15,,,
C,16,46.95,s,
C,17,30.97,s,
C,18,21.87,s,
C,19,21.87,s,
C,20,28.16,s,
C,21,35.28,s,
C,22,41.86,s,
C,23,23.79,s,
H,24,1.9,d,7.0
H,25,1.9,d,7.0
H,26,1.9,d,7.0
H,27,6.46,q,7.0
H,28,1.87,s,
H,29,1.87,s,
H,30,1.87,s,
H,31,4.9,d,3.6
H,32,5.72,d,3.6
H,33,1.88,s,
H,34,1.88,s,
H,35,1.88,s,
H,36,2.37,ddd,"13.4,8.2,1.2"
H,37,2.37,ddd,"13.4,12.2,0.7"
H,38,1.78,ddd,"12.4,12.2,1.2"
H,39,1.78,ddd,"12.4,8.2,0.7"
H,40,,,
H,41,2.13,ddd,"9.7,5.5,1.7"
H,42,1.87,m,"6.4,5.5"
H,43,0.88,d,6.4
H,44,0.88,d,6.4
H,45,0.88,d,6.4
H,46,0.88,d,6.4
H,47,0.88,d,6.4
H,48,0.88,d,6.4
H,49,1.58,m,
H,50,1.58,m,
H,51,1.72,ddd,"12.4,5.2,0.6"
H,52,1.72,ddd,"12.9,12.4,5.5"
H,53,1.13,s,
H,54,1.13,s,
H,55,1.13,s,
