ALIGN 6
1 1:C1c 1:C1c #M1
2 2:C6a 2:C6a
3 3:N1a 3:N1b #R1
4 4:R 4:R
5 5:O6a 5:O6a
6 6:O6a 6:O6a
- * 7:C5a #D1
ENTRY1
COMPOUND
C00151
ATOM 6
1 C1c C 21.5154 -15.8226
2 C6a C 22.7246 -16.5174
3 N1a N 20.2994 -16.5174
4 R R 21.5154 -14.3503
5 O6a O 22.7246 -18.0597
6 O6a O 23.9406 -15.8226
BOND 5
1 1 2 1
2 1 3 1
3 1 4 1 #Up
4 2 5 1
5 2 6 2
ENTRY2
COMPOUND
C03740
ATOM 15
1 C1c C 15.1738 -14.3375
2 C6a C 13.9988 -15.0125
3 N1b N 16.3487 -15.0188
4 R R 15.1800 -12.9750
5 O6a O 12.8237 -14.3250
6 O6a O 13.9988 -16.3688
7 C5a C 18.1550 -14.2688
8 C1b C 19.3176 -14.9624
9 O5a O 18.1550 -12.9000
10 C1b C 20.5863 -14.5126
11 C1c C 21.7050 -15.2688
12 C6a C 22.9676 -14.8187
13 N1a N 21.7488 -16.6626
14 O6a O 24.0801 -15.6001
15 O6a O 22.9676 -13.4813
BOND 14
1 1 2 1
2 1 3 1 #Down
3 1 4 1
4 2 5 1
5 2 6 2
6 3 7 1
7 7 8 1
8 7 9 2
9 8 10 1
10 10 11 1
11 11 12 1
12 11 13 1 #Up
13 12 14 1
14 12 15 2