C,1,13.9,s,
C,2,17.7,s,
C,3,32.2,s,
C,4,77.06,s,
O,5,,,
C,6,173.45,s,
O,7,,,
C,8,42.82,s,
C,9,12.94,s,
C,10,77.06,s,
C,11,29.2,s,
C,12,29.2,s,
C,13,77.06,s,
O,14,,,
C,15,37.71,s,
C,16,12.57,s,
C,17,87.3,s,
C,18,37.71,s,
C,19,12.57,s,
C,20,77.06,s,
C,21,29.2,s,
C,22,31.17,s,
C,23,74.13,s,
C,24,36.08,s,
C,25,58.68,s,
C,26,33.3,s,
C,27,20.7,s,
C,28,14.5,s,
N,29,,,
C,30,42.85,s,
C,31,42.85,s,
O,32,,,
O,33,,,
C,34,173.45,s,
O,35,,,
C,36,42.82,s,
C,37,12.94,s,
C,38,77.06,s,
C,39,29.2,s,
C,40,29.2,s,
C,41,77.06,s,
O,42,,,
C,43,38.76,s,
C,44,11.01,s,
H,45,0.92,t,7.0
H,46,0.92,t,7.0
H,47,0.92,t,7.0
H,48,1.4,qt,"7.0,6.6"
H,49,1.4,qt,"7.0,6.6"
H,50,1.8,td,"6.6,5.7"
H,51,1.8,td,"6.6,5.7"
H,52,4.88,td,"5.7,5.4"
H,53,2.82,dq,"7.1,6.7"
H,54,1.23,d,6.7
H,55,1.23,d,6.7
H,56,1.23,d,6.7
H,57,4.88,ddd,"9.3,7.1,6.7"
H,58,1.8,m,
H,59,1.8,m,
H,60,1.8,m,
H,61,1.8,m,
H,62,4.88,ddd,"8.5,7.6,7.5"
H,63,2.17,dqd,"7.5,6.6,1.2"
H,64,1.08,d,6.6
H,65,1.08,d,6.6
H,66,1.08,d,6.6
H,67,4.25,dd,"5.2,1.2"
H,68,2.17,qdd,"6.6,5.2,5.0"
H,69,1.08,d,6.6
H,70,1.08,d,6.6
H,71,1.08,d,6.6
H,72,4.88,ddd,"9.9,5.0,4.8"
H,73,1.8,m,
H,74,1.8,m,
H,75,1.8,ddt,"12.4,10.7,1.4"
H,76,1.8,m,
H,77,4.83,dtd,"8.6,5.6,1.4"
H,78,2.2,dd,"5.8,5.6"
H,79,2.2,dd,"5.8,5.6"
H,80,3.77,m,5.8
H,81,2.5,td,"6.6,5.8"
H,82,2.5,td,"6.6,5.8"
H,83,1.31,qt,"7.0,6.6"
H,84,1.31,qt,"7.0,6.6"
H,85,0.91,t,7.0
H,86,0.91,t,7.0
H,87,0.91,t,7.0
H,88,2.38,s,
H,89,2.38,s,
H,90,2.38,s,
H,91,2.38,s,
H,92,2.38,s,
H,93,2.38,s,
H,94,2.82,qd,"6.7,4.2"
H,95,1.23,d,6.7
H,96,1.23,d,6.7
H,97,1.23,d,6.7
H,98,4.88,ddd,"9.5,5.3,4.2"
H,99,1.8,ddd,"12.4,8.6,5.3"
H,100,1.8,m,
H,101,1.8,dd,"12.4,6.3"
H,102,1.8,m,
H,103,4.88,t,7.7
H,104,1.69,dqd,"7.7,6.6,5.4"
H,105,0.93,d,6.6
H,106,0.93,d,6.6
H,107,0.93,d,6.6
