RDKit 3D 70 73 0 0 0 0 0 0 0 0999 V2000 5.4301 2.4896 -1.6261 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1419 1.7025 -1.4036 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0814 0.8062 -0.1231 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0820 -0.3597 -0.2732 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4853 1.6479 1.1097 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6037 0.2727 0.0641 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3571 -0.4421 1.4228 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3300 -1.5708 1.3764 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1932 -1.2119 0.4482 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0161 -1.2506 0.9386 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9710 -0.9488 -0.0476 N 0 0 0 0 0 4 0 0 0 0 0 0 -2.5337 -1.8942 -0.8997 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4853 -1.3342 -1.7271 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7125 0.3402 -1.3900 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.5910 0.2418 -0.0788 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3166 1.1910 0.8143 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9193 2.5260 0.8733 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1564 2.4672 1.7697 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7472 3.8560 1.9973 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7055 4.8286 2.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4636 4.8826 1.6580 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8737 3.4933 1.4322 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1775 -3.3066 -0.9474 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1614 -4.0710 0.2292 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8200 -5.4275 0.1935 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4962 -6.0281 -1.0293 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5126 -5.2787 -2.2124 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8534 -3.9218 -2.1678 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1368 -7.4521 -1.0714 N 0 0 0 0 0 4 0 0 0 0 0 0 -1.0372 -8.0481 0.0091 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9536 -7.9631 -2.1845 O 0 0 0 0 0 1 0 0 0 0 0 0 0.5792 -0.8443 -0.9721 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0854 -0.6021 -1.0969 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3103 1.8425 -1.6333 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5658 3.2618 -0.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3867 2.9987 -2.5950 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9919 1.0821 -2.2946 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3124 2.4208 -1.3827 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8955 -0.9326 -1.1878 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0337 -1.0538 0.5703 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1142 0.0023 -0.3214 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5125 2.0190 1.0295 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4463 1.0683 2.0368 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8216 2.5114 1.2249 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9614 1.1677 0.0799 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0205 0.3125 2.1462 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2799 -0.8616 1.8351 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9529 -1.7832 2.3827 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7910 -2.4917 0.9999 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0717 -1.8112 -2.5021 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6738 0.8533 1.5218 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1961 2.8549 -0.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8949 2.0184 2.7363 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9152 1.8149 1.3236 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5907 3.7887 2.6936 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1443 4.2417 1.0505 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1437 5.8296 2.6265 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4165 4.5213 3.5564 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7107 5.5333 2.1174 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7246 5.3292 0.6906 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0223 3.5591 0.7437 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4742 3.1085 2.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4223 -3.6245 1.1882 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8140 -6.0001 1.1208 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2628 -5.7339 -3.1703 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8528 -3.3581 -3.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2829 -1.6483 -1.6513 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0458 0.0678 -1.2605 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2647 -0.1345 -2.0688 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6120 -1.5643 -1.1069 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 1 0 3 5 1 0 3 6 1 0 6 7 1 0 7 8 1 0 8 9 1 0 9 10 2 3 10 11 1 0 11 12 1 0 12 13 2 0 13 14 1 0 14 15 1 0 15 16 1 0 16 17 1 0 17 18 1 0 18 19 1 0 19 20 1 0 20 21 1 0 21 22 1 0 12 23 1 0 23 24 2 0 24 25 1 0 25 26 2 0 26 27 1 0 27 28 2 0 26 29 1 0 29 30 2 0 29 31 1 0 9 32 1 0 32 33 1 0 33 6 1 0 15 11 2 0 22 17 1 0 28 23 1 0 1 34 1 0 1 35 1 0 1 36 1 0 2 37 1 0 2 38 1 0 4 39 1 0 4 40 1 0 4 41 1 0 5 42 1 0 5 43 1 0 5 44 1 0 6 45 1 0 7 46 1 0 7 47 1 0 8 48 1 0 8 49 1 0 13 50 1 0 16 51 1 0 17 52 1 0 18 53 1 0 18 54 1 0 19 55 1 0 19 56 1 0 20 57 1 0 20 58 1 0 21 59 1 0 21 60 1 0 22 61 1 0 22 62 1 0 24 63 1 0 25 64 1 0 27 65 1 0 28 66 1 0 32 67 1 0 32 68 1 0 33 69 1 0 33 70 1 0 M CHG 3 11 1 29 1 31 -1 M END