RDKit 3D 57 61 0 0 0 0 0 0 0 0999 V2000 0.4921 -4.8153 1.0579 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2009 -3.6978 0.5536 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 -3.6902 -0.8140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2381 -4.7654 -1.1752 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0855 -5.4241 -0.0297 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4419 -2.8002 -1.9244 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3486 -1.3921 -1.5514 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4931 -0.8422 -0.9642 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5240 -1.4779 -0.7560 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4078 0.5738 -0.6638 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3639 1.4418 -0.0406 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8924 2.7430 -0.0017 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3282 2.8978 -0.6515 S 0 0 0 0 0 0 0 0 0 0 0 0 1.2588 1.2350 -1.0286 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1745 0.6909 -1.6206 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2394 -0.5900 -1.8202 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1797 -1.2977 -2.5660 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.0895 -1.8815 -1.0968 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9435 -0.9459 0.0977 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9392 -1.0601 0.8182 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8864 0.0630 0.3030 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7804 0.8143 1.5492 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3410 2.2235 1.4246 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7692 2.2036 0.9019 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8398 1.4335 -0.4133 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2565 0.0188 -0.3001 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.2205 -1.0263 0.3814 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3425 -0.5991 0.7749 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7552 -2.2017 0.4340 O 0 0 0 0 0 1 0 0 0 0 0 0 3.6276 3.9113 0.5764 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1177 3.5754 0.7383 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3245 2.1846 1.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7191 1.0674 0.4863 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3904 -5.1209 2.0867 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7545 -2.9641 1.1236 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7262 -6.2844 -0.1533 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8564 -2.9973 -2.8245 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4766 -3.0492 -2.1845 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7040 -2.8643 -0.7981 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1229 -2.0617 -1.3949 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3175 0.2529 2.3233 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7349 0.8828 1.8654 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7115 2.8050 0.7376 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3079 2.7251 2.3989 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1232 3.2260 0.7479 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4281 1.7488 1.6503 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8761 1.4023 -0.7691 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2689 1.9889 -1.1699 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1542 -0.3289 -1.3346 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1996 4.1534 1.5566 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5221 4.7978 -0.0595 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6076 3.6070 -0.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5974 4.3380 1.3633 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3915 1.9940 1.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8653 2.1650 2.3496 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6606 0.1456 1.0825 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3859 0.8677 -0.3659 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 3 6 1 0 6 7 1 0 7 8 1 0 8 9 2 0 8 10 1 0 10 11 1 0 11 12 2 0 12 13 1 0 13 14 1 0 14 15 1 0 15 16 2 0 16 17 1 0 17 18 1 0 18 19 1 0 19 20 2 0 19 21 1 0 21 22 1 0 22 23 1 0 23 24 1 0 24 25 1 0 25 26 1 0 26 27 1 0 27 28 2 0 27 29 1 0 12 30 1 0 30 31 1 0 31 32 1 0 32 33 1 0 5 1 2 0 16 7 1 0 14 10 2 0 33 11 1 0 26 21 1 0 1 34 1 0 2 35 1 0 5 36 1 0 6 37 1 0 6 38 1 0 18 39 1 0 18 40 1 0 22 41 1 0 22 42 1 0 23 43 1 0 23 44 1 0 24 45 1 0 24 46 1 0 25 47 1 0 25 48 1 0 26 49 1 6 30 50 1 0 30 51 1 0 31 52 1 0 31 53 1 0 32 54 1 0 32 55 1 0 33 56 1 0 33 57 1 0 M CHG 1 29 -1 M END