ALIGN 7
1 1:C1c 8:C1c #M1
2 2:C1c 7:C1b #R1 #M2
3 3:C6a 9:C6a
4 4:N1a 10:N1a
5 5:C1a 6:C1b #R2 #M1
6 7:O6a 11:O6a
7 8:O6a 12:O6a
- 6:O1a * #D1
- * 2:O2b #D2
ENTRY1
COMPOUND
C00188
ATOM 8
1 C1c C 4.4120 -12.3186
2 C1c C 5.1464 -11.9290
3 C6a C 3.7223 -11.8807
4 N1a N 4.3809 -13.1428
5 C1a C 5.8464 -12.3738
6 O1a O 5.1775 -11.1049
7 O6a O 2.9878 -12.2669
8 O6a O 3.7602 -11.0566
BOND 7
1 1 2 1
2 1 3 1
3 1 4 1 #Down
4 2 5 1
5 2 6 1 #Down
6 3 7 1
7 3 8 2
ENTRY2
COMPOUND
C01102
ATOM 12
1 P1b P 24.5910 -17.2252
2 O2b O 23.1937 -17.2316
3 O1c O 25.9947 -17.2252
4 O1c O 24.5910 -15.7579
5 O1c O 24.5974 -18.6289
6 C1b C 23.1937 -15.8344
7 C1b C 21.9767 -15.1325
8 C1c C 20.7661 -15.8344
9 C6a C 19.5555 -15.1325
10 N1a N 20.7661 -17.2316
11 O6a O 18.3449 -15.8408
12 O6a O 19.5555 -13.8751
BOND 11
1 1 2 1
2 1 3 1
3 1 4 1
4 1 5 2
5 2 6 1
6 6 7 1
7 7 8 1
8 8 9 1
9 8 10 1 #Down
10 9 11 1
11 9 12 2