C,1,19.8,s,
C,2,57.53,s,
N,3,,,
C,4,162.36,s,
O,5,,,
C,6,57.53,s,
C,7,32.8,s,
C,8,110.16,s,
C,9,123.99,s,
N,10,,,
C,11,136.38,s,
C,12,111.5,s,
C,13,121.51,s,
C,14,119.23,s,
C,15,118.5,s,
C,16,127.47,s,
N,17,,,
C,18,162.36,s,
O,19,,,
C,20,57.53,s,
N,21,,,
C,22,35.29,s,
C,23,134.98,s,
C,24,129.1,s,
C,25,128.8,s,
C,26,126.94,s,
C,27,128.8,s,
C,28,129.1,s,
C,29,174.5,s,
O,30,,,
O,31,,,
H,32,1.29,d,6.5
H,33,1.29,d,6.5
H,34,1.29,d,6.5
H,35,4.28,q,6.5
H,36,,,
H,37,4.28,t,6.3
H,38,3.5,d,6.3
H,39,3.5,d,6.3
H,40,7.11,d,0.5
H,41,,,
H,42,7.34,ddd,"7.4,1.4,0.5"
H,43,7.14,ddd,"8.2,7.4,1.4"
H,44,7.01,ddd,"8.2,6.5,1.4"
H,45,7.57,ddt,"6.5,1.4,0.5"
H,46,,,
H,47,4.28,t,6.4
H,48,,,
H,49,,,
H,50,3.01,d,6.4
H,51,3.01,d,6.4
H,52,7.25,m,
H,53,7.24,m,
H,54,7.22,ddt,"8.5,7.1,1.4"
H,55,7.24,m,
H,56,7.25,m,
H,57,,,
