ENTRY D00948 Drug ATOM 30 1 C1y C 21.6300 -17.8902 2 C1y C 20.4529 -17.2027 3 C1y C 22.8128 -17.2260 4 C1x C 21.6300 -19.2537 5 C8y C 19.2643 -17.8786 6 C1x C 20.4645 -15.8392 7 C1z C 22.8185 -15.8566 8 C1x C 25.1841 -17.2377 9 C1x C 20.4412 -19.9296 10 C8y C 19.2584 -19.2420 11 C8x C 18.0873 -17.1968 12 C1x C 21.6474 -15.1691 13 C5x C 24.0130 -15.1808 14 C1x C 25.1900 -15.8683 15 C8x C 18.0873 -19.9296 16 C8x C 16.8987 -17.8786 17 O5x O 24.0072 -13.7999 18 C8y C 16.8987 -19.2420 19 O2a O 15.7159 -19.9296 20 S4a S 14.5447 -19.2420 21 O1d O 15.5060 -18.2748 22 O1d O 13.5716 -18.2748 23 O1d O 13.5716 -20.2092 24 C1a C 22.8185 -14.4566 25 C1x C 27.5614 -15.7169 26 C1x C 27.5614 -17.1270 27 N1x N 28.7735 -15.0234 28 N1x N 28.7735 -17.8262 29 C1x C 29.9853 -15.7169 30 C1x C 29.9853 -17.1270 BOND 33 1 1 2 1 2 1 3 1 3 1 4 1 4 2 5 1 5 2 6 1 6 3 7 1 7 3 8 1 8 4 9 1 9 5 10 2 10 5 11 1 11 6 12 1 12 7 13 1 13 8 14 1 14 10 15 1 15 11 16 2 16 13 17 2 17 15 18 2 18 18 19 1 19 19 20 1 20 20 21 2 21 20 22 2 22 20 23 1 23 7 12 1 24 9 10 1 25 13 14 1 26 16 18 1 27 7 24 1 #Up 28 25 26 1 29 25 27 1 30 26 28 1 31 27 29 1 32 28 30 1 33 29 30 1 ///