ALIGN 1
1 4:N1a 4:N1a #R1
- 1:C1c * #D1
- * 1: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
C00123
ATOM 9
1 C1c C 25.0761 -19.4138
2 C1b C 26.2633 -18.6769
3 C6a C 23.8420 -18.7586
4 N1a N 25.1229 -20.8173
5 C1c C 27.4974 -19.3377
6 O6a O 22.6841 -19.5483
7 O6a O 23.8654 -17.3551
8 C1a C 28.6846 -18.6007
9 C1a C 27.5442 -20.7356
BOND 8
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 5 9 1