RDKit 3D 45 47 0 0 0 0 0 0 0 0999 V2000 -0.9458 -1.2587 0.5085 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4521 -1.1963 0.5695 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1195 -0.0564 0.1276 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3799 1.0154 -0.3767 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0159 0.9515 -0.4389 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6988 -0.1851 0.0098 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1720 -0.2580 -0.0619 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9044 -0.7114 0.9726 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4022 -0.7922 0.9933 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0138 -0.1977 -0.1938 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.2697 -0.3460 -1.4423 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8498 0.2105 -1.3238 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3802 -0.0352 -0.2947 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0050 0.0720 -1.3438 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.0575 0.0127 0.8803 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4769 0.1300 0.1371 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5236 -1.0036 0.6666 S 0 0 0 0 0 0 0 0 0 0 0 0 3.4688 -2.1490 -0.2250 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3292 -1.1751 2.0963 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0999 -0.2277 0.4183 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9202 0.0681 1.5084 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1420 0.7066 1.2879 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5548 1.0528 -0.0113 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7134 0.7331 -1.0916 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4905 0.0943 -0.8840 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8795 1.7573 -0.2429 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5958 1.9903 0.7809 O 0 0 0 0 0 0 0 0 0 0 0 0 9.1673 2.0619 -1.4431 O 0 0 0 0 0 1 0 0 0 0 0 0 -1.4378 -2.1688 0.8462 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9825 -2.0580 0.9663 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8910 1.9114 -0.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5583 1.8100 -0.8277 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4157 -1.0315 1.8907 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7163 -1.8409 1.0478 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7676 -0.2827 1.8912 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2496 -1.4157 -1.6881 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7871 0.1634 -2.2633 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2805 -0.0959 -2.2092 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8925 1.3069 -1.3185 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6393 0.6014 1.5862 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0371 0.2228 0.7285 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6273 -0.1818 2.5243 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7919 0.9476 2.1294 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0300 0.9927 -2.1011 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8610 -0.1449 -1.7365 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 2 3 1 0 3 4 2 0 4 5 1 0 5 6 2 0 6 7 1 0 7 8 2 0 8 9 1 0 9 10 1 0 10 11 1 0 11 12 1 0 10 13 1 0 13 14 2 0 13 15 1 0 3 16 1 0 16 17 1 0 17 18 2 0 17 19 2 0 17 20 1 0 20 21 2 0 21 22 1 0 22 23 2 0 23 24 1 0 24 25 2 0 23 26 1 0 26 27 2 0 26 28 1 0 6 1 1 0 12 7 1 0 25 20 1 0 1 29 1 0 2 30 1 0 4 31 1 0 5 32 1 0 8 33 1 0 9 34 1 0 9 35 1 0 11 36 1 0 11 37 1 0 12 38 1 0 12 39 1 0 15 40 1 0 15 41 1 0 21 42 1 0 22 43 1 0 24 44 1 0 25 45 1 0 M CHG 1 28 -1 M END