C,1,55.5,s,
O,2,,,
C,3,152.8,s,
O,4,,,
N,5,,,
C,6,162.36,s,
O,7,,,
C,8,57.53,s,
N,9,,,
C,10,162.36,s,
O,11,,,
C,12,61.74,s,
C,13,26.69,s,
C,14,74.3,s,
O,15,,,
C,16,165.16,s,
C,17,104.0,s,
C,18,124.64,s,
N,19,,,
C,20,32.76,s,
C,21,137.91,s,
C,22,109.5,s,
C,23,131.57,s,
Cl,24,,,
C,25,115.25,s,
C,26,154.16,s,
O,27,,,
C,28,118.5,s,
N,29,,,
C,30,57.53,s,
C,31,29.71,s,
C,32,25.0,s,
C,33,46.85,s,
N,34,,,
H,35,3.73,s,
H,36,3.73,s,
H,37,3.73,s,
H,38,,,
H,39,4.28,d,5.3
H,40,,,
H,41,1.41,s,
H,42,1.41,s,
H,43,1.41,s,
H,44,4.12,s,
H,45,4.12,s,
H,46,7.54,s,
H,47,3.6,s,
H,48,3.6,s,
H,49,3.6,s,
H,50,7.9,d,1.4
H,51,6.92,d,1.4
H,52,,,
H,53,4.28,ddd,"9.3,8.1,5.3"
H,54,1.84,m,
H,55,1.84,m,
H,56,1.57,m,
H,57,1.57,m,
H,58,3.11,ddd,"9.4,6.8,0.3"
H,59,3.11,ddd,"12.7,9.4,4.8"
H,60,,,
