ALIGN 1
1 4:N1a 6:N1a #R1
- 1:C1c * #D1
- * 2:C1c #D1
ENTRY1
COMPOUND
C00025
ATOM 10
1 C1c C 20.3373 -15.3609
2 C1b C 21.5254 -14.6234
3 C6a C 19.1024 -14.6995
4 N1a N 20.3782 -16.7596
5 C1b C 22.7603 -15.2789
6 O6a O 17.9435 -15.4955
7 O6a O 19.1199 -13.3008
8 C6a C 23.9484 -14.5415
9 O6a O 25.1832 -15.2029
10 O6a O 23.9016 -13.1427
BOND 9
1 1 2 1
2 1 3 1
3 1 4 1 #Down
4 2 5 1
5 3 6 1
6 3 7 2
7 5 8 1
8 8 9 1
9 8 10 2
ENTRY2
COMPOUND
C03618
ATOM 10
1 C1c C 17.8437 -14.4672
2 C1c C 19.0841 -15.1035
3 C6a C 16.6933 -15.2256
4 C1a C 17.8502 -13.1168
5 C6a C 20.3246 -14.4864
6 N1a N 19.2112 -16.6838
7 O6a O 16.6805 -16.6703
8 O6a O 15.4078 -14.6022
9 O6a O 21.5136 -15.2191
10 O6a O 20.3246 -13.1048
BOND 9
1 1 2 1
2 1 3 1
3 1 4 1 #Up
4 2 5 1
5 2 6 1 #Up
6 3 7 1
7 3 8 2
8 5 9 1
9 5 10 2