RDKit 3D 57 56 0 0 0 0 0 0 0 0999 V2000 7.7579 -1.7843 3.3339 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3591 -1.2669 3.1243 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6793 -0.8126 4.0673 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8732 -1.3294 1.8017 N 0 0 0 0 0 0 0 0 0 0 0 0 6.6062 -1.8382 0.7673 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5328 -0.8265 1.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7059 0.6054 1.1001 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4433 1.3177 0.6778 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8663 0.6477 -0.4656 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6858 1.1530 -1.1187 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1543 2.1937 -0.6967 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1819 0.3861 -2.2681 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1624 1.0712 -3.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7176 2.2838 -3.6179 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0789 1.4807 -2.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8488 0.2998 -1.8439 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0940 -0.6817 -1.5592 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1487 0.4581 -1.7318 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.5339 0.6229 -1.6109 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0304 0.5468 -0.2078 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7593 -0.7682 0.4585 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3401 -0.6455 1.8143 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.5571 -0.1678 2.7924 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.6866 -1.0265 2.0298 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3204 -0.9250 3.3579 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3654 -1.4653 1.0597 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1602 0.2182 -4.3144 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6754 -0.9093 -4.1702 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1222 0.7091 -5.5695 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3665 -1.2269 2.5631 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1011 -1.4639 4.3261 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8571 -2.8460 3.1105 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0359 -1.1707 0.2128 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8293 -1.0179 2.3044 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1650 -1.4266 0.6171 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2461 1.1886 1.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3914 0.6302 0.2014 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7448 2.3401 0.3409 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7331 1.4436 1.5206 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3307 -0.2298 -0.8185 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9890 -0.6673 -1.9895 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1277 0.3073 -2.9545 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0315 2.8526 -3.9256 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7682 2.0075 -3.1448 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8921 2.2314 -1.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3090 -0.8501 -1.2808 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1556 -0.0452 -2.2837 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7617 1.6838 -1.9675 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1107 0.8372 -0.2087 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4684 1.3522 0.3656 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6742 -0.9084 0.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2156 -1.6208 -0.0465 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8466 -0.4104 3.6809 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2331 -1.5658 3.3808 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6103 -1.3028 4.1201 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5592 0.1267 3.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4697 1.6254 -5.7664 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 2 0 2 4 1 0 4 5 1 0 4 6 1 0 6 7 1 0 7 8 1 0 8 9 1 0 9 10 1 0 10 11 2 0 10 12 1 0 12 13 1 0 13 14 1 0 13 15 1 0 15 16 1 0 16 17 2 0 16 18 1 0 18 19 1 0 19 20 1 0 20 21 1 0 21 22 1 0 22 23 1 0 22 24 1 0 24 25 1 0 24 26 2 0 13 27 1 0 27 28 2 0 27 29 1 0 1 30 1 0 1 31 1 0 1 32 1 0 5 33 1 0 6 34 1 0 6 35 1 0 7 36 1 0 7 37 1 0 8 38 1 0 8 39 1 0 9 40 1 0 12 41 1 0 12 42 1 0 14 43 1 0 15 44 1 0 15 45 1 0 18 46 1 0 19 47 1 0 19 48 1 0 20 49 1 0 20 50 1 0 21 51 1 0 21 52 1 0 23 53 1 0 25 54 1 0 25 55 1 0 25 56 1 0 29 57 1 0 M END