C,1,22.42,s,
C,2,24.66,s,
C,3,22.42,s,
C,4,36.24,s,
C,5,57.53,s,
N,6,,,
C,7,162.36,s,
O,8,,,
C,9,49.05,s,
N,10,,,
C,11,162.36,s,
O,12,,,
C,13,49.05,s,
N,14,,,
C,15,162.36,s,
O,16,,,
C,17,57.53,s,
C,18,19.8,s,
N,19,,,
C,20,162.36,s,
O,21,,,
C,22,57.53,s,
C,23,32.8,s,
C,24,110.16,s,
C,25,123.99,s,
N,26,,,
C,27,136.38,s,
C,28,111.5,s,
C,29,121.51,s,
C,30,119.23,s,
C,31,118.5,s,
C,32,127.47,s,
N,33,,,
C,34,162.36,s,
O,35,,,
C,36,57.53,s,
C,37,30.56,s,
C,38,18.38,s,
C,39,18.38,s,
N,40,,,
C,41,162.36,s,
O,42,,,
C,43,57.53,s,
C,44,19.8,s,
N,45,,,
C,46,162.36,s,
O,47,,,
C,48,49.05,s,
N,49,,,
C,50,162.36,s,
O,51,,,
C,52,57.53,s,
C,53,36.24,s,
C,54,24.66,s,
C,55,22.42,s,
C,56,22.42,s,
N,57,,,
C,58,162.36,s,
O,59,,,
H,60,0.8,d,6.4
H,61,0.8,d,6.4
H,62,0.8,d,6.4
H,63,1.67,m,"6.4,5.9"
H,64,0.8,d,6.4
H,65,0.8,d,6.4
H,66,0.8,d,6.4
H,67,1.87,dd,"6.2,5.9"
H,68,1.87,dd,"6.2,5.9"
H,69,4.28,t,6.2
H,70,,,
H,71,4.05,s,
H,72,4.05,s,
H,73,,,
H,74,4.05,s,
H,75,4.05,s,
H,76,,,
H,77,4.28,q,6.5
H,78,1.29,d,6.5
H,79,1.29,d,6.5
H,80,1.29,d,6.5
H,81,,,
H,82,4.28,t,6.3
H,83,3.5,d,6.3
H,84,3.5,d,6.3
H,85,7.11,d,0.5
H,86,,,
H,87,7.34,ddd,"6.7,1.4,0.5"
H,88,7.14,ddd,"8.7,6.7,1.4"
H,89,7.01,ddd,"8.7,6.7,1.4"
H,90,7.57,ddt,"6.7,1.4,0.5"
H,91,,,
H,92,4.03,d,5.4
H,93,2.19,m,"6.4,5.4"
H,94,0.82,d,6.4
H,95,0.82,d,6.4
H,96,0.82,d,6.4
H,97,0.82,d,6.4
H,98,0.82,d,6.4
H,99,0.82,d,6.4
H,100,,,
H,101,4.28,q,6.5
H,102,1.29,d,6.5
H,103,1.29,d,6.5
H,104,1.29,d,6.5
H,105,,,
H,106,4.05,s,
H,107,4.05,s,
H,108,,,
H,109,4.28,t,6.2
H,110,1.87,dd,"6.2,5.9"
H,111,1.87,dd,"6.2,5.9"
H,112,1.67,m,"6.4,5.9"
H,113,0.8,d,6.4
H,114,0.8,d,6.4
H,115,0.8,d,6.4
H,116,0.8,d,6.4
H,117,0.8,d,6.4
H,118,0.8,d,6.4
H,119,,,
