ENTRY D09813 Drug ATOM 39 1 C8x C 19.9500 -19.5300 2 C8x C 19.9500 -20.9300 3 C8x C 21.2100 -21.6300 4 C8y C 22.4000 -20.9300 5 C8y C 22.4000 -19.5300 6 C8y C 21.2100 -18.8300 7 C5x C 23.7300 -21.4200 8 N1y N 24.5700 -20.2300 9 C1x C 23.7300 -19.1100 10 C1y C 25.9000 -20.2300 11 O5x O 24.1500 -22.7500 12 N1a N 21.2100 -17.4300 13 C1x C 26.6700 -21.4900 14 C1x C 28.0700 -21.4900 15 C5x C 28.7700 -20.2300 16 N1x N 28.0700 -19.0400 17 C5x C 26.6700 -19.0400 18 O5x O 25.9700 -17.8500 19 O5x O 30.1700 -20.2300 20 O0 O 35.2800 -20.7900 21 C8x C 19.9500 -19.5300 22 C8x C 19.9500 -20.9300 23 C8x C 21.2100 -21.6300 24 C8y C 22.4000 -20.9300 25 C8y C 22.4000 -19.5300 26 C8y C 21.2100 -18.8300 27 N1a N 21.2100 -17.4300 28 C1x C 23.7300 -19.1100 29 N1y N 24.5700 -20.2300 30 C5x C 23.7300 -21.4200 31 O5x O 24.1500 -22.7500 32 C1y C 25.9000 -20.2300 33 C1x C 26.6700 -21.4900 34 C1x C 28.0700 -21.4900 35 C5x C 28.7700 -20.2300 36 N1x N 28.0700 -19.0400 37 C5x C 26.6700 -19.0400 38 O5x O 25.9700 -17.8500 39 O5x O 30.1700 -20.2300 BOND 42 1 1 2 2 2 2 3 1 3 3 4 2 4 4 5 1 5 5 6 2 6 1 6 1 7 4 7 1 8 7 8 1 9 8 9 1 10 5 9 1 11 8 10 1 12 7 11 2 13 6 12 1 14 10 13 1 15 13 14 1 16 14 15 1 17 15 16 1 18 16 17 1 19 10 17 1 20 17 18 2 21 15 19 2 22 21 22 2 23 22 23 1 24 23 24 2 25 24 25 1 26 25 26 2 27 21 26 1 28 24 30 1 29 30 29 1 30 29 28 1 31 25 28 1 32 29 32 1 33 30 31 2 34 26 27 1 35 32 33 1 36 33 34 1 37 34 35 1 38 35 36 1 39 36 37 1 40 32 37 1 41 37 38 2 42 35 39 2 BRACKET 1 19.1800 -23.8700 19.1800 -16.3100 1 31.0100 -16.3100 31.0100 -23.8700 1 2 ORIGINAL 1 1 2 3 4 5 6 12 9 8 7 11 10 13 14 15 16 1 17 18 19 REPEAT 1 21 22 23 24 25 26 27 28 29 30 31 32 33 34 35 36 1 37 38 39 ///