C,1,39.2,s,
N,2,,,
C,3,63.2,s,
C,4,25.37,s,
C,5,25.37,s,
C,6,63.2,s,
C,7,34.4,s,
C,8,64.8,s,
O,9,,,
C,10,166.7,s,
O,11,,,
C,12,130.2,s,
C,13,130.2,s,
C,14,128.88,s,
C,15,133.32,s,
C,16,128.88,s,
C,17,130.2,s,
C,18,34.4,s,
H,19,2.25,s,
H,20,2.25,s,
H,21,2.25,s,
H,22,3.18,m,
H,23,2.03,m,
H,24,2.03,m,
H,25,2.03,m,
H,26,2.03,m,
H,27,3.18,m,
H,28,2.13,ddd,"12.4,8.3,0.8"
H,29,2.13,ddd,"12.4,8.9,1.3"
H,30,5.14,m,
H,31,8.03,m,
H,32,7.46,m,
H,33,7.57,ddt,"8.1,8.0,1.4"
H,34,7.46,m,
H,35,8.03,m,
H,36,2.13,ddd,"12.4,9.4,2.0"
H,37,2.13,ddd,"12.4,6.1,2.5"
