ENTRY C00877 Compound ATOM 53 1 C2b C 29.6324 -29.8200 2 C5a C 30.8449 -29.1200 3 S2a S 32.0573 -29.8200 4 C1b C 33.2697 -29.1200 5 C1b C 34.4822 -29.8200 6 N1b N 35.6946 -29.1200 7 C5a C 36.9070 -29.8200 8 C1b C 38.1195 -29.1200 9 C1b C 39.3319 -29.8200 10 N1b N 40.5444 -29.1200 11 C5a C 41.7568 -29.8200 12 C1c C 42.9692 -29.1200 13 C1d C 44.1817 -29.8200 14 C1b C 45.3941 -29.1200 15 O2b O 46.6065 -29.8200 16 O5a O 30.8449 -27.7202 17 O5a O 36.9070 -31.2199 18 O5a O 41.7568 -31.2196 19 O1a O 42.9692 -27.7200 20 C1a C 44.1817 -28.4200 21 C1a C 44.1817 -31.2200 22 P1b P 48.0065 -29.8200 23 O1c O 49.4065 -29.8200 24 O1c O 48.0065 -31.2200 25 C1y C 41.5100 -24.8500 26 C1y C 42.9100 -24.8500 27 C1y C 43.3426 -23.5185 28 O2x O 42.2100 -22.6956 29 C1y C 41.0774 -23.5185 30 C1b C 44.6622 -23.0897 31 O1a O 40.6871 -25.9826 32 O2b O 43.7329 -25.9826 33 P1b P 45.1329 -25.9826 34 O1c O 45.1329 -24.5826 35 O1c O 46.5329 -25.9826 36 O1c O 45.1329 -27.3826 37 C8y C 36.9600 -21.7000 38 C8y C 36.9600 -23.1000 39 N4y N 39.3849 -23.1000 40 C8x C 39.3849 -21.7000 41 N5x N 38.1724 -21.0000 42 C8y C 35.7476 -21.0000 43 N5x N 34.5351 -21.7000 44 C8x C 34.5351 -23.1000 45 N5x N 35.7476 -23.8000 46 N1a N 35.7476 -19.6002 47 O2b O 46.6445 -23.5220 48 P1b P 48.0445 -23.5220 49 O1c O 48.0445 -22.1220 50 O1c O 49.4445 -23.5220 51 O2c O 48.0445 -26.7420 52 C2b C 28.4033 -29.1102 53 C1a C 27.1992 -29.8053 BOND 55 1 1 2 1 2 2 3 1 3 3 4 1 4 4 5 1 5 5 6 1 6 6 7 1 7 7 8 1 8 8 9 1 9 9 10 1 10 10 11 1 11 11 12 1 12 12 13 1 13 13 14 1 14 14 15 1 15 2 16 2 16 7 17 2 17 11 18 2 18 12 19 1 #Down 19 13 20 1 20 13 21 1 21 15 22 1 22 22 23 2 23 22 24 1 24 25 26 1 25 26 27 1 26 27 28 1 27 28 29 1 28 25 29 1 29 27 30 1 #Down 30 25 31 1 #Up 31 26 32 1 #Up 32 32 33 1 33 33 34 1 34 33 35 1 35 33 36 2 36 37 38 2 37 38 39 1 38 39 40 1 39 40 41 2 40 37 41 1 41 37 42 1 42 42 43 2 43 43 44 1 44 44 45 2 45 38 45 1 46 42 46 1 47 29 39 1 #Down 48 30 47 1 49 47 48 1 50 48 49 1 51 48 50 2 52 48 51 1 53 22 51 1 54 1 52 2 55 52 53 1 ///