RDKit 3D 49 53 0 0 0 0 0 0 0 0999 V2000 7.2688 -2.0176 1.5451 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2903 -0.9995 1.7400 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1008 0.3011 1.4543 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7851 0.6861 0.9212 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3798 1.8472 0.5786 N 0 0 0 0 0 4 0 0 0 0 0 0 4.9886 1.7719 0.0982 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7079 0.3120 0.2473 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7584 -0.3603 0.7344 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0504 -1.7211 1.0626 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4254 -0.2613 -0.1297 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0555 -1.4952 -0.1360 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8060 -1.4721 -0.6538 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3547 -0.0990 -0.7624 C 0 0 1 0 0 0 0 0 0 0 0 0 2.5252 0.6811 -0.5088 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6804 0.3018 -2.3981 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.5495 -1.0329 -2.5714 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4896 -1.0612 -1.3757 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1477 -1.6245 -0.3372 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6612 -0.3583 -1.5873 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7371 -0.1855 -0.6897 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7980 -0.7795 0.5825 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8939 -0.5665 1.4285 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9291 0.2324 0.9813 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8809 0.8246 -0.2817 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7949 0.6298 -1.1213 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0916 1.6730 -0.5179 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0492 1.1310 0.5532 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1752 0.6263 1.7105 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5239 -3.0440 1.8031 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2451 -1.3416 2.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8815 1.0363 1.6087 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9667 2.6770 0.6424 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3703 2.3997 0.7449 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9669 2.1123 -0.9402 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3007 -2.4952 0.9203 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1293 -2.0377 -0.1305 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6324 0.1611 0.0184 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0564 -2.0053 -2.6679 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1115 -0.8708 -3.4968 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7617 0.1155 -2.4778 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0054 -1.4237 0.9487 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9260 -1.0263 2.4115 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7821 1.1102 -2.0944 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5034 1.5452 -1.5228 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8534 2.7266 -0.3397 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7807 1.8781 0.8767 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6143 0.2861 0.1351 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6437 -0.2165 2.2263 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9575 1.4294 2.4220 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 2 0 5 6 1 0 6 7 1 0 7 8 2 0 8 9 1 0 7 10 1 0 10 11 2 0 11 12 1 0 12 13 1 0 13 14 1 0 13 15 1 0 15 16 1 0 16 17 1 0 17 18 2 0 17 19 1 0 19 20 1 0 20 21 2 0 21 22 1 0 22 23 2 0 23 24 1 0 24 25 2 0 24 26 1 0 26 27 1 0 27 28 1 0 9 1 2 0 8 4 1 0 14 10 1 0 25 20 1 0 28 23 1 0 1 29 1 0 2 30 1 0 3 31 1 0 5 32 1 0 6 33 1 0 6 34 1 0 9 35 1 0 12 36 1 0 13 37 1 1 16 38 1 0 16 39 1 0 19 40 1 0 21 41 1 0 22 42 1 0 25 43 1 0 26 44 1 0 26 45 1 0 27 46 1 0 27 47 1 0 28 48 1 0 28 49 1 0 M CHG 1 5 1 M END