1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26
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24
CNC([O-])=C([NH+]=C/CC(O)=O)C
C -2.556678 0.114722 2.210515
N -1.574462 -0.349138 1.239483
C -1.904034 -0.457985 -0.155194
O -3.232642 -0.302238 -0.546195
C -0.966494 -0.730104 -1.087538
N 0.427199 -0.840257 -0.754990
C 1.092105 0.147352 -0.230092
C 2.561240 0.016689 0.040720
C 3.100486 1.267714 0.656912
O 3.558862 2.298976 -0.156791
O 3.102269 1.404874 1.909590
C -1.374380 -0.984624 -2.510552
H -3.439707 -0.558481 2.206157
H -2.111682 0.114593 3.227998
H -2.874962 1.148135 1.958357
H -0.640753 -0.650254 1.597297
H 0.935831 -1.703609 -1.053567
H 0.583052 1.075451 0.012696
H 2.735155 -0.841168 0.725633
H 3.095098 -0.182181 -0.912985
H 3.911867 3.159469 0.244615
H -2.018310 -1.887864 -2.563522
H -0.479802 -1.150228 -3.147414
H -1.929257 -0.109841 -2.911136
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