C,1,52.0,s,
O,2,,,
C,3,171.25,s,
O,4,,,
C,5,46.85,s,
C,6,42.11,s,
C,7,35.12,s,
C,8,29.04,s,
C,9,21.02,s,
C,10,53.05,s,
N,11,,,
C,12,51.33,s,
C,13,37.2,s,
C,14,58.4,s,
C,15,139.0,s,
C,16,123.1,s,
C,17,121.2,s,
C,18,127.0,s,
C,19,111.8,s,
C,20,149.2,s,
N,21,,,
C,22,61.74,s,
C,23,34.93,s,
C,24,35.28,s,
C,25,71.28,s,
H,26,3.14,s,
H,27,3.14,s,
H,28,3.14,s,
H,29,4.09,dd,"11.6,9.1"
H,30,2.04,dd,"12.4,9.1"
H,31,2.04,dd,"12.4,11.6"
H,32,1.58,ddd,"12.4,12.2,6.4"
H,33,1.58,ddd,"12.4,6.0,2.2"
H,34,1.61,m,
H,35,1.61,m,
H,36,2.81,ddd,"12.4,10.3,2.5"
H,37,2.81,ddd,"12.4,10.4,7.3"
H,38,3.11,ddd,"10.4,9.4,2.2"
H,39,3.11,ddd,"9.4,9.2,9.1"
H,40,2.18,ddd,"12.4,9.2,2.2"
H,41,2.18,ddd,"12.4,10.4,9.1"
H,42,7.25,ddd,"8.4,1.4,0.5"
H,43,6.94,ddd,"8.4,6.8,1.4"
H,44,7.22,ddd,"9.0,6.8,1.4"
H,45,7.15,ddd,"9.0,1.4,0.5"
H,46,,,
H,47,1.99,ddd,"12.4,8.9,0.6"
H,48,1.99,ddd,"12.4,12.1,8.7"
H,49,1.72,ddd,"12.4,8.7,0.6"
H,50,1.72,ddd,"12.4,12.1,8.9"
H,51,2.67,s,
