C,1,11.5,s,
C,2,23.2,s,
C,3,125.4,s,
C,4,141.72,s,
N,5,,,
C,6,49.76,s,
C,7,30.68,s,
C,8,132.07,s,
C,9,130.19,s,
C,10,125.4,s,
C,11,117.8,s,
C,12,131.3,s,
C,13,119.45,s,
C,14,161.0,s,
N,15,,,
C,16,145.66,s,
C,17,145.66,s,
C,18,117.2,s,
C,19,132.07,s,
C,20,132.07,s,
C,21,141.72,s,
N,22,,,
C,23,149.93,s,
C,24,110.86,s,
C,25,129.93,s,
C,26,119.9,s,
C,27,122.0,s,
C,28,133.6,s,
C,29,52.77,s,
C,30,42.57,s,
C,31,50.96,s,
N,32,,,
C,33,52.69,s,
C,34,140.57,s,
C,35,127.2,s,
C,36,58.8,s,
O,37,,,
C,38,31.54,s,
C,39,26.77,s,
C,40,60.23,s,
C,41,47.72,s,
C,42,77.16,s,
O,43,,,
C,44,61.05,s,
H,45,1.4,t,7.2
H,46,1.4,t,7.2
H,47,1.4,t,7.2
H,48,3.22,q,7.2
H,49,3.22,q,7.2
H,50,7.61,s,
H,51,3.34,ddd,"12.4,11.5,1.9"
H,52,3.34,ddd,"12.4,11.2,4.8"
H,53,2.73,ddd,"15.4,11.2,1.9"
H,54,2.73,ddd,"15.4,11.5,4.8"
H,55,7.66,ddd,"7.0,1.4,0.5"
H,56,7.11,ddd,"8.8,7.0,1.4"
H,57,7.51,ddd,"8.8,7.6,1.4"
H,58,7.26,ddd,"7.6,1.4,0.5"
H,59,7.45,s,
H,60,7.61,s,
H,61,7.32,ddd,"7.8,1.4,0.5"
H,62,7.43,ddd,"8.1,7.8,1.4"
H,63,7.04,ddd,"8.4,8.1,1.4"
H,64,7.11,ddd,"8.4,1.4,0.5"
H,65,1.85,ddd,"12.4,5.2,0.4"
H,66,1.85,ddd,"13.1,12.4,8.0"
H,67,3.01,ddd,"13.1,9.4,5.2"
H,68,3.01,ddd,"9.4,8.0,0.4"
H,69,3.2,s,
H,70,3.2,s,
H,71,5.7,t,7.0
H,72,4.18,d,7.0
H,73,4.18,d,7.0
H,74,,,
H,75,3.12,ddd,"3.8,3.6,3.3"
H,76,1.88,ddd,"12.4,3.8,2.3"
H,77,1.88,ddd,"12.4,3.6,3.3"
H,78,3.91,dd,"3.3,2.3"
H,79,1.24,ddd,"10.6,9.6,3.3"
H,80,4.19,d,10.6
H,81,,,
H,82,3.54,d,9.6
