ALIGN 11
1 1:C8y 1:C8y
2 2:C1b 2:C1b
3 3:C8x 3:C8x
4 4:N5x 4:N5x
5 5:C1c 5:C1c #M1
6 6:N4x 6:N4x
7 7:C8x 7:C8x
8 8:C6a 9:C6a
9 9:N1a 8:N1b #R1
10 10:O6a 12:O6a
11 11:O6a 11:O6a
- * 10:C5a #D1
ENTRY1
COMPOUND
C00135
ATOM 11
1 C8y C 24.9301 -16.1704
2 C1b C 23.7417 -15.4887
3 C8x C 24.9301 -17.4169
4 N5x N 27.0970 -16.1704
5 C1c C 22.5476 -16.1704
6 N4x N 26.0077 -18.0402
7 C8x C 27.0970 -17.4169
8 C6a C 21.3651 -15.4887
9 N1a N 22.5476 -17.5451
10 O6a O 20.1709 -16.1704
11 O6a O 21.3651 -14.1082
BOND 11
1 1 2 1
2 1 3 2
3 1 4 1
4 2 5 1
5 3 6 1
6 4 7 2
7 5 8 1
8 5 9 1 #Down
9 8 10 1
10 8 11 2
11 6 7 1
ENTRY2
COMPOUND
C00884
ATOM 17
1 C8y C 22.9272 -17.6488
2 C1b C 24.2309 -17.0429
3 C8x C 21.8418 -16.8007
4 N5x N 22.6412 -19.0477
5 C1c C 24.6334 -15.4407
6 N4x N 20.6534 -17.9109
7 C8x C 21.2320 -19.2043
8 N1b N 23.4761 -14.6136
9 C6a C 25.9541 -14.8450
10 C5a C 22.1826 -15.2058
11 O6a O 27.1182 -15.6688
12 O6a O 26.2200 -13.6954
13 C1b C 21.0321 -14.3787
14 O5a O 22.1675 -16.4029
15 C1b C 19.7318 -14.9642
16 C1b C 18.5541 -14.1370
17 N1a N 17.2538 -14.7327
BOND 17
1 1 2 1
2 1 3 2
3 1 4 1
4 2 5 1
5 3 6 1
6 4 7 2
7 5 8 1
8 5 9 1
9 8 10 1
10 9 11 1
11 9 12 2
12 10 13 1
13 10 14 2
14 13 15 1
15 15 16 1
16 16 17 1
17 6 7 1
