C,1,55.7,s,
O,2,,,
C,3,146.95,s,
C,4,111.07,s,
C,5,127.92,s,
C,6,136.19,s,
C,7,125.49,s,
C,8,149.13,s,
O,9,,,
C,10,60.1,s,
C,11,53.95,s,
N,12,,,
C,13,49.76,s,
C,14,28.2,s,
C,15,131.87,s,
C,16,110.47,s,
C,17,147.78,s,
C,18,147.29,s,
C,19,110.34,s,
C,20,128.65,s,
C,21,146.97,s,
C,22,117.49,s,
O,23,,,
C,24,101.24,s,
O,25,,,
H,26,3.87,s,
H,27,3.87,s,
H,28,3.87,s,
H,29,6.68,d,7.7
H,30,6.75,d,7.7
H,31,3.84,s,
H,32,3.84,s,
H,33,3.84,s,
H,34,4.25,s,
H,35,4.25,s,
H,36,3.34,ddd,"12.4,7.2,1.1"
H,37,3.34,ddd,"12.5,12.4,6.4"
H,38,2.85,ddd,"15.4,12.5,7.2"
H,39,2.85,ddd,"15.4,6.4,1.1"
H,40,6.68,d,0.5
H,41,6.94,d,0.5
H,42,7.07,s,
H,43,6.12,s,
H,44,6.12,s,
