C,1,15.1,s,
S,2,,,
C,3,80.76,s,
C,4,35.07,s,
C,5,108.3,s,
C,6,125.4,s,
N,7,,,
C,8,136.4,s,
C,9,111.5,s,
C,10,121.51,s,
C,11,120.3,s,
C,12,119.1,s,
C,13,128.3,s,
N,14,,,
C,15,162.36,s,
O,16,,,
C,17,80.76,s,
C,18,61.05,s,
O,19,,,
S,20,,,
C,21,15.1,s,
N,22,,,
C,23,28.11,s,
C,24,165.39,s,
O,25,,,
H,26,1.74,s,
H,27,1.74,s,
H,28,1.74,s,
H,29,2.05,s,
H,30,2.05,s,
H,31,7.12,d,0.5
H,32,,,
H,33,7.34,ddd,"6.8,1.4,0.5"
H,34,7.14,ddd,"8.4,6.8,1.4"
H,35,7.01,ddd,"8.4,7.4,1.4"
H,36,7.57,ddt,"7.4,1.4,0.5"
H,37,,,
H,38,4.1,s,
H,39,4.1,s,
H,40,,,
H,41,1.74,s,
H,42,1.74,s,
H,43,1.74,s,
H,44,3.35,s,
H,45,3.35,s,
H,46,3.35,s,
