RDKit 3D 40 42 0 0 0 0 0 0 0 0999 V2000 3.2027 1.4704 1.0774 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9310 2.1226 0.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8114 1.3677 -1.0824 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0385 0.2691 -0.8196 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6642 0.3402 0.4951 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7949 -0.7732 1.0074 C 0 0 2 0 0 0 0 0 0 0 0 0 2.4041 -2.1701 0.6418 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4568 -2.4416 -0.8208 N 0 0 0 0 0 4 0 0 0 0 0 0 0.3320 -0.6314 0.6802 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3374 0.1688 1.7581 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7755 0.6554 1.4398 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3395 -0.1690 0.2998 N 0 0 0 0 0 4 0 0 0 0 0 0 -1.5123 0.0025 -0.9568 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0111 -0.0097 -0.6274 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8254 -0.0198 0.1949 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5095 -0.0408 -1.1395 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3846 1.2502 -0.3772 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5655 1.7235 -2.7908 Br 0 0 0 0 0 0 0 0 0 0 0 0 4.8583 3.7279 0.3201 Br 0 0 0 0 0 0 0 0 0 0 0 0 3.0887 1.7894 2.1062 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8816 -0.7522 2.1043 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8188 -2.9807 1.0877 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4372 -2.2429 0.9995 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0109 -3.2859 -1.0239 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5257 -2.5778 -1.2255 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9154 -1.6588 -1.3167 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2570 1.0521 2.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3857 -0.4622 2.6545 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7837 1.7017 1.1154 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4290 0.5251 2.3088 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1839 -1.1480 0.5826 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7626 -0.8426 -1.6063 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7869 0.9472 -1.4352 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3604 1.0309 -0.6526 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5188 -0.5348 -1.4431 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3866 -0.4568 1.0231 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4985 -0.4898 -1.1962 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9625 -0.1276 -2.0686 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2900 1.6557 0.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7316 2.0153 -0.7774 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 2 0 3 4 1 0 4 5 1 0 5 6 1 0 6 7 1 0 7 8 1 0 6 9 1 0 9 10 1 0 10 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 12 15 1 0 15 16 1 0 16 17 1 0 3 18 1 0 2 19 1 0 5 1 2 0 14 9 1 0 17 15 1 0 1 20 1 0 6 21 1 1 7 22 1 0 7 23 1 0 8 24 1 0 8 25 1 0 8 26 1 0 10 27 1 0 10 28 1 0 11 29 1 0 11 30 1 0 12 31 1 0 13 32 1 0 13 33 1 0 14 34 1 0 14 35 1 0 15 36 1 0 16 37 1 0 16 38 1 0 17 39 1 0 17 40 1 0 M CHG 2 8 1 12 1 M END