RDKit 3D 40 41 0 0 0 0 0 0 0 0999 V2000 2.9239 1.6614 1.7054 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9550 1.2761 0.5995 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3781 -0.0305 -0.0485 N 0 0 0 0 0 4 0 0 0 0 0 0 3.5791 0.1004 -0.9618 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4215 -1.1616 -0.9059 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2049 -0.8250 -0.6883 C 0 0 2 0 0 0 0 0 0 0 0 0 0.3569 -0.0177 -1.6704 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6180 0.7906 -1.0084 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5129 0.0264 -0.2961 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8535 0.4445 -0.2324 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7826 -0.3290 0.5153 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3166 -1.4531 1.2345 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9744 -1.8332 1.1907 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0851 -1.0973 0.4160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3489 -1.4330 0.4055 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8656 -2.1044 1.2949 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4613 -2.5067 2.3296 Br 0 0 0 0 0 0 0 0 0 0 0 0 -5.2416 0.0613 0.5888 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2976 1.6823 -0.9743 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9268 1.8719 1.3247 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0025 0.8675 2.4554 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5686 2.5653 2.2108 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8965 2.0379 -0.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9681 1.1277 1.0444 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6584 -0.6406 0.7407 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2201 0.3067 -1.9741 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1776 0.9521 -0.6288 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8717 -2.0380 -1.2601 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7639 -1.3619 0.1147 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3066 -1.0471 -1.5399 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6703 -1.6564 -1.2285 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1603 -0.6883 -2.3707 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9771 0.6454 -2.2816 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6253 -2.6898 1.7650 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8857 -0.8087 0.4252 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5280 0.7829 -0.1803 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4615 0.5035 1.5657 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4582 2.2624 -1.3691 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8456 2.3523 -0.3036 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9339 1.4037 -1.8203 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 3 6 1 0 6 7 1 0 7 8 1 0 8 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 2 0 12 17 1 0 11 18 1 0 10 19 1 0 15 6 1 0 14 9 1 0 1 20 1 0 1 21 1 0 1 22 1 0 2 23 1 0 2 24 1 0 3 25 1 0 4 26 1 0 4 27 1 0 5 28 1 0 5 29 1 0 5 30 1 0 6 31 1 6 7 32 1 0 7 33 1 0 13 34 1 0 18 35 1 0 18 36 1 0 18 37 1 0 19 38 1 0 19 39 1 0 19 40 1 0 M CHG 1 3 1 M END