C,1,28.8,s,
C,2,94.2,s,
O,3,,,
C,4,83.38,s,
C,5,38.31,s,
C,6,70.48,s,
O,7,,,
C,8,72.8,s,
O,9,,,
N,10,,,
C,11,137.8,s,
C,12,109.4,s,
C,13,126.5,s,
C,14,120.8,s,
C,15,127.2,s,
C,16,124.5,s,
C,17,115.87,s,
C,18,130.1,s,
C,19,133.8,s,
C,20,115.8,s,
C,21,125.9,s,
C,22,122.8,s,
C,23,122.0,s,
C,24,126.5,s,
C,25,113.4,s,
C,26,139.5,s,
N,27,,,
C,28,127.41,s,
C,29,131.5,s,
C,30,50.28,s,
N,31,,,
C,32,162.36,s,
O,33,,,
H,34,2.52,s,
H,35,2.52,s,
H,36,2.52,s,
H,37,6.54,dd,"9.7,9.1"
H,38,2.67,ddd,"12.4,11.4,9.1"
H,39,2.67,ddd,"12.4,9.7,3.2"
H,40,4.17,ddd,"11.4,3.2,2.4"
H,41,,,
H,42,4.52,d,2.4
H,43,,,
H,44,7.5,ddd,"8.0,1.4,0.5"
H,45,7.54,ddd,"8.0,7.0,1.4"
H,46,7.34,ddd,"9.2,7.0,1.4"
H,47,9.31,ddd,"9.2,1.4,0.5"
H,48,8.06,ddd,"7.2,1.4,0.5"
H,49,7.41,ddd,"7.5,7.2,1.4"
H,50,7.53,ddd,"8.0,7.5,1.4"
H,51,8.04,ddd,"8.0,1.4,0.5"
H,52,4.61,s,
H,53,4.61,s,
H,54,,,
