ALIGN 1
1 4:N1a 5: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
C03846
ATOM 13
1 C1b C 19.3193 -15.1160
2 C1c C 20.4905 -14.4369
3 C1b C 18.1480 -14.4369
4 C1b C 21.6679 -15.1160
5 N1a N 20.4905 -13.0849
6 C1b C 16.9706 -15.1160
7 C6a C 22.8392 -14.4369
8 N1b N 15.2199 -14.3870
9 O6a O 24.0103 -15.1221
10 O6a O 22.8329 -13.0849
11 C5a C 14.0487 -15.0598
12 C1a C 12.8776 -14.3809
13 O5a O 14.0487 -16.4181
BOND 12
1 1 2 1
2 1 3 1
3 2 4 1
4 2 5 1
5 3 6 1
6 4 7 1
7 6 8 1
8 7 9 1
9 7 10 2
10 8 11 1
11 11 12 1
12 11 13 2