RDKit 3D 57 57 0 0 0 0 0 0 0 0999 V2000 5.7177 0.0337 -0.5420 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2925 0.2751 0.8623 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8308 0.3688 1.1244 C 0 0 1 0 0 0 0 0 0 0 0 0 3.6840 0.5845 2.5275 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1012 1.4771 0.4524 C 0 0 1 0 0 0 0 0 0 0 0 0 3.6601 2.8457 0.8377 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9300 1.4079 -1.0087 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1752 0.1919 -1.4355 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7643 0.1343 -0.8860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1124 -1.1035 -1.3924 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0142 -1.1943 -2.8944 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3626 -2.0730 -0.6700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3219 -2.0803 0.7979 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7007 -2.2395 1.4188 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.2392 -3.4492 0.9957 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6126 -1.1082 1.0657 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2429 0.2526 1.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7356 -1.3197 0.4245 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6929 -0.2573 0.0354 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2754 0.9251 -0.5241 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7612 1.7477 -0.7424 S 0 0 0 0 0 0 0 0 0 0 0 0 -6.8076 0.5553 -0.1188 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3124 0.5695 0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9718 -0.4050 0.2227 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0081 -0.4802 -1.1921 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0758 0.9518 -1.0608 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6362 -0.6312 -0.5165 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7128 -0.5615 1.4968 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8533 1.1716 1.2263 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3344 -0.5937 0.9298 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7517 -0.2975 2.9716 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0579 1.5075 0.9079 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9619 3.5955 0.4117 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6489 2.9863 1.9387 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6350 2.9727 0.3665 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8601 1.5650 -1.5956 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3032 2.3217 -1.2916 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6806 -0.7703 -1.1461 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0646 0.1570 -2.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7810 0.2378 0.1964 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1858 1.0164 -1.2733 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7730 -1.9158 -3.1871 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2136 -0.1917 -3.2871 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9737 -1.5137 -3.3472 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8134 -2.9246 -1.2229 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2090 -3.0468 1.0901 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1641 -1.2162 1.2188 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5776 -2.2433 2.5051 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3112 -3.5013 0.0121 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5362 0.6742 0.7331 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0808 0.9532 1.5921 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6434 0.2394 2.4357 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9796 -2.3514 0.1596 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2481 1.2487 -0.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6052 1.3902 0.6963 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6053 -0.3861 0.4859 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7561 0.6221 -0.9812 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 3 5 1 0 5 6 1 0 5 7 1 0 7 8 1 0 8 9 1 0 9 10 1 0 10 11 1 0 10 12 2 0 12 13 1 0 13 14 1 0 14 15 1 0 14 16 1 0 16 17 1 0 16 18 2 0 18 19 1 0 19 20 2 0 20 21 1 0 21 22 1 0 22 23 1 0 22 24 2 0 24 19 1 0 1 25 1 0 1 26 1 0 1 27 1 0 2 28 1 0 2 29 1 0 3 30 1 6 4 31 1 0 5 32 1 1 6 33 1 0 6 34 1 0 6 35 1 0 7 36 1 0 7 37 1 0 8 38 1 0 8 39 1 0 9 40 1 0 9 41 1 0 11 42 1 0 11 43 1 0 11 44 1 0 12 45 1 0 13 46 1 0 13 47 1 0 14 48 1 1 15 49 1 0 17 50 1 0 17 51 1 0 17 52 1 0 18 53 1 0 20 54 1 0 23 55 1 0 23 56 1 0 23 57 1 0 M END