RDKit 3D 44 48 0 0 0 0 0 0 0 0999 V2000 1.2739 3.2310 1.1319 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1143 1.8482 0.9823 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4271 1.4208 -0.3077 C 0 0 1 0 0 0 0 0 0 0 0 0 2.6440 0.5551 -0.2461 C 0 0 1 0 0 0 0 0 0 0 0 0 3.2417 0.6675 1.0335 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4830 -0.8661 -0.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6331 -1.6526 -0.5328 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8742 -1.0899 -0.3214 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5222 -3.0050 -0.7773 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2784 -3.6110 -0.9966 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1273 -2.8518 -0.9708 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2794 -1.5202 -0.7257 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1175 -0.6354 -0.6778 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1459 -0.8618 -0.3613 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8786 -2.0881 0.0651 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1583 -1.8205 0.8124 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9281 -0.7170 0.1964 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1419 -0.7921 0.0114 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2268 0.5195 -0.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8276 1.7377 -0.3457 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1424 1.9154 -0.1037 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9880 2.7998 -0.7493 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6468 2.6237 -0.9955 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0394 1.3673 -0.8566 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8965 0.3709 -0.4636 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2692 0.7979 -1.0177 C 0 0 1 0 0 0 0 0 0 0 0 0 0.6098 3.7676 0.4254 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0176 3.5762 2.1334 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3208 3.5449 0.9407 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7123 2.3333 -0.8746 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4553 0.9177 -0.9449 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9556 1.3330 1.0495 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7055 -1.6642 -0.3446 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4091 -3.6279 -0.8037 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2374 -4.6579 -1.1818 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1728 -3.3167 -1.1467 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2177 -2.7712 0.6456 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1443 -2.6425 -0.8595 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7989 -2.7474 0.7141 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9513 -1.6281 1.8881 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8015 1.2598 0.1883 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4573 3.7556 -0.8534 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9922 3.4221 -1.3067 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5021 0.8021 -2.1286 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 4 5 1 0 4 6 1 0 6 7 2 0 7 8 1 0 7 9 1 0 9 10 2 0 10 11 1 0 11 12 2 0 12 13 1 0 13 14 2 0 14 15 1 0 15 16 1 0 16 17 1 0 17 18 2 0 17 19 1 0 19 20 2 0 20 21 1 0 20 22 1 0 22 23 2 0 23 24 1 0 24 25 2 0 24 26 1 0 26 3 1 0 12 6 1 0 26 13 1 0 25 14 1 0 25 19 1 0 1 27 1 0 1 28 1 0 1 29 1 0 3 30 1 6 4 31 1 6 5 32 1 0 8 33 1 0 9 34 1 0 10 35 1 0 11 36 1 0 15 37 1 0 15 38 1 0 16 39 1 0 16 40 1 0 21 41 1 0 22 42 1 0 23 43 1 0 26 44 1 6 M END