ENTRY C05898 Compound ATOM 133 1 O2a O 29.7500 -16.3800 2 C1y C 26.8800 -17.7100 3 C1y C 26.8800 -19.1100 4 O2x O 25.6900 -17.0100 5 C1y C 25.6900 -19.7400 6 N1b N 28.0700 -19.7400 7 C1y C 24.5000 -17.7100 8 C1y C 24.5000 -19.0400 9 O1a O 25.6900 -21.1400 10 C5a C 29.2600 -19.0400 11 C1b C 23.3100 -17.0100 12 O1a O 23.3100 -19.7400 13 C1a C 30.3800 -19.7400 14 O5a O 29.2600 -17.6400 15 O1a O 23.3100 -15.6100 16 C1y C 35.3500 -16.5900 17 C1y C 34.0900 -17.2900 18 C1y C 35.3500 -15.1900 19 N1b N 36.6100 -17.5700 20 C1y C 32.9000 -16.5900 21 O2a O 34.0900 -20.1600 22 O2x O 34.0900 -14.4900 23 O2b O 36.5400 -14.4900 24 C1y C 32.9000 -15.1900 25 C1c C 32.9000 -20.8600 26 P1b P 37.9400 -14.4900 27 C1b C 31.7100 -14.4900 28 C5a C 32.9000 -22.2600 29 C1a C 31.6400 -20.1600 30 O2c O 39.3400 -14.4900 31 O1c O 37.9400 -13.0200 32 O1c O 37.9400 -15.8900 33 O1a O 31.7100 -12.8800 34 N1b N 31.6400 -22.9600 35 O5a O 34.0900 -22.9600 36 C1c C 30.4500 -23.6600 37 C5a C 29.1900 -22.8900 38 C1a C 30.4500 -25.0600 39 N1b N 28.0000 -23.5900 40 O5a O 29.1900 -21.4900 41 C1c C 26.8100 -24.2900 42 C6a C 25.6200 -23.8700 43 C1b C 26.8100 -25.6900 44 O6a O 25.6200 -22.4700 45 C1b C 47.5300 -11.3400 46 C1b C 46.4800 -12.0400 47 C2c C 45.2200 -11.3400 48 C1a C 45.2200 -9.9400 49 C1b C 44.0300 -13.4400 50 C2b C 44.0300 -12.0400 51 O2b O 42.2800 -14.4900 52 C1a C 61.2500 -12.0400 53 C2c C 59.9900 -11.3400 54 C2b C 58.7300 -12.0400 55 C1a C 59.9900 -9.9400 56 C1b C 57.4700 -11.3400 57 C1b C 56.2800 -12.0400 58 C2c C 55.0200 -11.3400 59 C2b C 53.7600 -12.0400 60 C1a C 55.0200 -9.9400 61 C1b C 52.5000 -11.3400 62 C1b C 51.3100 -12.0400 63 C2c C 50.0500 -11.3400 64 C2b C 48.7900 -12.0400 65 C1a C 50.0500 -9.9400 66 P1b P 40.8100 -14.4900 67 O1c O 40.8100 -13.0200 68 O1c O 40.8100 -15.9600 69 O6a O 24.4300 -24.5700 70 C1b C 25.6200 -26.3900 71 C5a C 25.6200 -27.7900 72 N1b N 24.4300 -28.4900 73 O5a O 26.8100 -28.4900 74 C1c C 23.3100 -29.8200 75 C5a C 22.0500 -29.3300 76 C1b C 23.3100 -31.2200 77 N1b N 20.7900 -30.1000 78 O5a O 22.0500 -27.9300 79 C1b C 24.5000 -31.9200 80 C1c C 19.6000 -30.8000 81 C1b C 24.5000 -33.3900 82 C5a C 18.4100 -30.0300 83 C1a C 19.6000 -32.2000 84 C1c C 25.7600 -34.0900 85 N1b N 17.1500 -30.7300 86 O5a O 18.4100 -28.6300 87 C6a C 25.7600 -35.4900 88 N1a N 26.9500 -33.3900 89 C1c C 15.9600 -31.5000 90 O6a O 26.9500 -36.1900 91 O6a O 24.5000 -36.1900 92 C6a C 14.7700 -30.5900 93 C1a C 15.9600 -32.9000 94 O6a O 13.5800 -31.2900 95 O6a O 14.7700 -29.1900 96 C5a C 38.0469 -18.4427 97 C1a C 39.2801 -17.5410 98 O5a O 38.0810 -19.8031 99 C1b C 46.4800 -12.0400 100 C2c C 45.2200 -11.3400 101 C1a C 45.2200 -9.9400 102 C1b C 44.0300 -13.4400 103 C2b C 44.0300 -12.0400 104 C1b C 46.4800 -12.0400 105 C2c C 45.2200 -11.3400 106 C1a C 45.2200 -9.9400 107 C1b C 44.0300 -13.4400 108 C2b C 44.0300 -12.0400 109 C1b C 46.4800 -12.0400 110 C2c C 45.2200 -11.3400 111 C1a C 45.2200 -9.9400 112 C1b C 44.0300 -13.4400 113 C2b C 44.0300 -12.0400 114 C1b C 46.4800 -12.0400 115 C2c C 45.2200 -11.3400 116 C1a C 45.2200 -9.9400 117 C1b C 44.0300 -13.4400 118 C2b C 44.0300 -12.0400 119 C1b C 46.4800 -12.0400 120 C2c C 45.2200 -11.3400 121 C1a C 45.2200 -9.9400 122 C1b C 44.0300 -13.4400 123 C2b C 44.0300 -12.0400 124 C1b C 46.4800 -12.0400 125 C2c C 45.2200 -11.3400 126 C1a C 45.2200 -9.9400 127 C1b C 44.0300 -13.4400 128 C2b C 44.0300 -12.0400 129 C1b C 46.4800 -12.0400 130 C2c C 45.2200 -11.3400 131 C1a C 45.2200 -9.9400 132 C1b C 44.0300 -13.4400 133 C2b C 44.0300 -12.0400 BOND 134 1 2 1 1 #Up 2 2 3 1 3 2 4 1 4 3 5 1 5 3 6 1 #Down 6 4 7 1 7 5 8 1 8 5 9 1 #Up 9 6 10 1 10 7 11 1 #Up 11 8 12 1 #Down 12 10 13 1 13 10 14 2 14 11 15 1 15 7 8 1 16 16 17 1 17 16 18 1 18 16 19 1 #Down 19 17 20 1 20 17 21 1 #Up 21 18 22 1 22 18 23 1 #Down 23 20 24 1 24 20 1 1 #Down 25 21 25 1 26 23 26 1 27 24 27 1 #Up 28 25 28 1 29 25 29 1 #Up 30 26 30 1 31 26 31 1 32 26 32 2 33 27 33 1 34 28 34 1 35 28 35 2 36 36 34 1 #Up 37 36 37 1 38 36 38 1 39 37 39 1 40 37 40 2 41 41 39 1 #Down 42 41 42 1 43 41 43 1 44 42 44 2 45 22 24 1 46 56 57 1 47 57 58 1 48 58 59 2 49 58 60 1 50 59 61 1 51 54 56 1 52 52 53 1 53 53 54 2 54 61 62 1 55 62 63 1 56 63 64 2 57 63 65 1 58 64 45 1 59 53 55 1 60 51 66 1 61 66 30 1 62 66 67 1 63 66 68 2 64 42 69 1 65 43 70 1 66 70 71 1 67 71 72 1 68 71 73 2 69 74 72 1 #Up 70 74 75 1 71 74 76 1 72 75 77 1 73 75 78 2 74 76 79 1 75 80 77 1 #Down 76 79 81 1 77 80 82 1 78 80 83 1 79 81 84 1 80 82 85 1 81 82 86 2 82 84 87 1 83 84 88 1 #Up 84 89 85 1 #Down 85 87 90 1 86 87 91 2 87 89 92 1 88 89 93 1 89 92 94 1 90 92 95 2 91 19 96 1 92 96 97 1 93 96 98 2 94 45 46 1 95 47 48 1 96 47 46 1 97 49 50 1 98 50 47 2 99 49 99 1 100 100 101 1 101 100 99 1 102 102 103 1 103 103 100 2 104 102 104 1 105 105 106 1 106 105 104 1 107 107 108 1 108 108 105 2 109 107 109 1 110 110 111 1 111 110 109 1 112 112 113 1 113 113 110 2 114 112 114 1 115 115 116 1 116 115 114 1 117 117 118 1 118 118 115 2 119 117 119 1 120 120 121 1 121 120 119 1 122 122 123 1 123 123 120 2 124 122 124 1 125 125 126 1 126 125 124 1 127 127 128 1 128 128 125 2 129 127 129 1 130 130 131 1 131 130 129 1 132 132 133 1 133 133 130 2 134 132 51 1 BRACKET 1 43.6800 -14.4900 43.6800 -9.3100 1 46.6900 -9.3100 46.6900 -14.4900 1 8 ORIGINAL 1 46 47 48 49 50 REPEAT 1 99 100 101 102 103 104 105 106 107 108 109 110 111 112 113 114 1 115 116 117 118 119 120 121 122 123 124 125 126 127 128 129 130 1 131 132 133 ///