RDKit 3D 57 61 0 0 0 0 0 0 0 0999 V2000 7.4589 -0.2309 -0.2295 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9777 -0.1026 -0.4655 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5142 0.2992 -1.6721 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0983 0.4298 -1.9571 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2090 0.1257 -1.0002 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6528 -0.3105 0.2496 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0125 -0.3993 0.5616 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2066 -0.7239 1.8224 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9486 -0.8886 2.3469 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9588 -0.6418 1.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5289 -0.6571 1.6320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0633 -0.2770 2.7139 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5469 -1.1064 0.6104 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6883 -2.0962 -0.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6916 -2.1967 -0.9431 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9773 -2.9685 -1.8482 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5284 -1.2775 -0.3121 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8021 -0.4785 0.6395 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.7616 1.0073 0.2739 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6006 1.4465 -1.0529 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5386 2.8093 -1.3504 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6262 3.7418 -0.3255 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7773 3.3356 0.9960 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8439 1.9723 1.2926 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5532 5.0639 -0.6552 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8942 -1.1759 -0.4896 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6474 -0.3709 0.2297 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.9757 -0.4504 -0.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2280 -1.3579 -1.1733 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7427 -2.0747 -1.6612 S 0 0 0 0 0 0 0 0 0 0 0 0 -6.4538 -1.7649 -1.8411 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4894 -2.3266 -2.9387 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.7626 -1.4762 -1.1475 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9219 0.4501 0.5545 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6161 -2.8869 -0.5951 O 0 0 0 0 0 1 0 0 0 0 0 0 3.7860 -1.2841 3.7657 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7099 -1.2599 0.0489 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7716 0.4334 0.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0463 0.0276 -1.1169 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1939 0.5277 -2.4871 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7801 0.7443 -2.9442 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1451 0.1846 -1.1709 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2774 -0.6215 1.6192 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5174 0.7258 -1.8652 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4153 3.1360 -2.3784 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8392 4.0542 1.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9469 1.6575 2.3301 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5636 5.5773 0.1684 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5634 -2.0378 -1.6395 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9999 -0.4125 -1.2162 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7248 -1.8026 -0.1052 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4935 1.0527 -0.1573 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6122 -0.1248 1.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3825 1.1422 1.2101 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4154 -0.4415 4.3573 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7418 -1.6039 4.1928 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0814 -2.1163 3.8599 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 9 10 2 0 10 11 1 0 11 12 2 0 11 13 1 0 13 14 2 0 14 15 1 0 15 16 2 0 15 17 1 0 17 18 1 0 18 19 1 0 19 20 2 0 20 21 1 0 21 22 2 0 22 23 1 0 23 24 2 0 22 25 1 0 17 26 1 0 26 27 2 0 27 28 1 0 28 29 2 0 29 30 1 0 29 31 1 0 31 32 2 0 31 33 1 0 28 34 1 0 14 35 1 0 9 36 1 0 7 2 1 0 10 6 1 0 18 13 1 0 24 19 1 0 30 26 1 0 1 37 1 0 1 38 1 0 1 39 1 0 3 40 1 0 4 41 1 0 5 42 1 0 18 43 1 1 20 44 1 0 21 45 1 0 23 46 1 0 24 47 1 0 25 48 1 0 33 49 1 0 33 50 1 0 33 51 1 0 34 52 1 0 34 53 1 0 34 54 1 0 36 55 1 0 36 56 1 0 36 57 1 0 M CHG 1 35 -1 M END