C,1,22.99,s,
C,2,52.53,s,
C,3,22.99,s,
N,4,,,
C,5,157.99,s,
C,6,97.82,s,
C,7,145.66,s,
N,8,,,
C,9,145.12,s,
C,10,125.87,s,
C,11,129.18,s,
C,12,130.34,s,
Cl,13,,,
C,14,129.18,s,
C,15,125.87,s,
C,16,132.61,s,
C,17,115.89,s,
C,18,124.22,s,
C,19,123.56,s,
C,20,128.82,s,
C,21,136.69,s,
N,22,,,
C,23,157.99,s,
C,24,97.82,s,
C,25,144.6,s,
N,26,,,
C,27,139.72,s,
C,28,119.24,s,
C,29,128.9,s,
C,30,126.2,s,
Cl,31,,,
C,32,128.9,s,
C,33,119.24,s,
H,34,1.19,d,6.1
H,35,1.19,d,6.1
H,36,1.19,d,6.1
H,37,3.43,m,6.1
H,38,1.19,d,6.1
H,39,1.19,d,6.1
H,40,1.19,d,6.1
H,41,6.79,s,
H,42,6.9,ddd,"6.4,1.4,0.5"
H,43,7.18,ddd,"6.4,1.4,0.5"
H,44,7.18,ddd,"8.5,1.4,0.5"
H,45,6.9,ddd,"8.5,1.4,0.5"
H,46,6.67,ddd,"6.5,1.4,0.5"
H,47,6.82,ddd,"8.7,6.5,1.4"
H,48,7.26,ddd,"8.7,6.8,1.4"
H,49,7.73,ddd,"6.8,1.4,0.5"
H,50,6.79,s,
H,51,,,
H,52,7.28,ddd,"7.7,2.4,0.5"
H,53,7.22,ddd,"7.7,1.4,0.5"
H,54,7.22,ddd,"8.7,1.4,0.5"
H,55,7.28,ddd,"8.7,2.4,0.5"
