RDKit 3D 58 65 0 0 0 0 0 0 0 0999 V2000 3.4679 1.2405 -1.4982 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4516 0.3758 -1.0705 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7731 -0.1689 0.1545 C 0 0 2 0 0 0 0 0 0 0 0 0 3.0287 -1.6479 -0.0782 C 0 0 1 0 0 0 0 0 0 0 0 0 3.7821 -2.1676 1.0155 N 0 0 0 0 0 4 0 0 0 0 0 0 3.3379 -3.0990 1.7364 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0261 -1.6793 1.3360 O 0 0 0 0 0 1 0 0 0 0 0 0 1.7491 -2.3937 -0.2716 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8039 -2.0901 0.8643 C 0 0 1 0 0 0 0 0 0 0 0 0 1.1860 -1.1251 1.7015 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7259 0.0563 1.2121 C 0 0 1 0 0 0 0 0 0 0 0 0 2.4087 0.6665 2.4408 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6788 0.9308 0.6860 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7129 2.2653 0.6082 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6571 3.2207 0.9132 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4406 4.5675 0.7276 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2442 5.0171 0.2178 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7271 4.0967 -0.1016 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4898 2.7563 0.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2895 1.6574 -0.1572 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5652 1.4887 -0.6611 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1431 0.2329 -0.8143 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3806 -0.8577 -0.4386 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6177 -2.2108 -0.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6851 -2.9834 -0.8558 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5895 -4.3592 -0.7508 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4534 -4.9470 -0.2683 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3967 -4.1610 0.1157 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4512 -2.7958 0.0275 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5429 -1.8576 0.3449 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0912 -0.6601 0.0694 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5466 0.5923 0.2123 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4600 0.4365 -1.3557 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3166 -0.3929 -1.6474 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6821 1.8406 -1.5329 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5076 2.5336 -1.1094 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2268 1.6869 -2.4782 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6851 2.0436 -0.7872 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4062 0.6571 -1.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7756 0.2382 0.4821 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6328 -1.7328 -1.0187 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9916 -3.4745 -0.3384 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2827 -2.1389 -1.2606 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7174 -3.0425 1.4611 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4672 0.9483 2.2363 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5430 -0.1202 3.2605 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8034 1.4289 2.9393 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5890 2.8738 1.2946 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2218 5.3085 0.9842 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0937 6.0856 0.0792 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6714 4.4570 -0.5044 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6001 -2.6122 -1.2393 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4307 -4.9999 -1.0556 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4250 -6.0288 -0.2043 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4846 -4.6185 0.5023 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5423 2.3090 -1.9048 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0419 3.1246 -1.9514 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7790 3.2279 -0.2776 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 4 5 1 0 5 6 2 0 5 7 1 0 4 8 1 0 8 9 1 0 9 10 1 0 10 11 1 0 11 12 1 1 11 13 1 0 13 14 1 0 14 15 2 0 15 16 1 0 16 17 2 0 17 18 1 0 18 19 2 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 25 26 1 0 26 27 2 0 27 28 1 0 28 29 2 0 29 30 1 0 30 31 1 0 31 32 2 0 22 33 1 0 33 34 2 0 33 35 1 0 35 36 1 0 11 3 1 0 32 13 1 0 30 9 1 0 19 14 1 0 32 20 1 0 36 21 1 0 31 23 1 0 29 24 1 0 1 37 1 0 1 38 1 0 1 39 1 0 3 40 1 1 4 41 1 6 8 42 1 0 8 43 1 0 9 44 1 1 12 45 1 0 12 46 1 0 12 47 1 0 15 48 1 0 16 49 1 0 17 50 1 0 18 51 1 0 25 52 1 0 26 53 1 0 27 54 1 0 28 55 1 0 35 56 1 0 36 57 1 0 36 58 1 0 M CHG 2 5 1 7 -1 M END