9EJ Converted by convert_cif2sdf.py 2024/03/29 11:09:15 73 77 0 0 0 0 0 0 0 0999 V2000 -3.6819 1.4161 -1.4424 C 0 0 0 0 0 -4.5835 -0.2040 0.1568 N 0 0 0 0 0 -6.0481 0.6341 -1.6177 C 0 0 0 0 0 -5.2782 -1.4866 0.3346 C 0 0 0 0 0 -4.7721 0.5204 2.4883 C 0 0 0 0 0 3.9227 2.9710 -1.8541 C 0 0 0 0 0 5.3347 2.9719 -1.2415 C 0 0 0 0 0 4.6855 2.3591 0.0120 C 0 0 0 0 0 6.8412 3.0142 3.1047 C 0 0 0 0 0 0.2669 0.3585 0.0016 C 0 0 0 0 0 0.0294 1.5825 -0.6254 C 0 0 0 0 0 1.0997 2.4672 -0.7808 C 0 0 0 0 0 2.3558 2.1017 -0.3094 C 0 0 0 0 0 2.5452 0.9334 0.2815 N 0 0 0 0 0 1.5544 0.0643 0.4488 C 0 0 0 0 0 -1.3242 1.9343 -1.1156 C 0 0 0 0 0 -2.3440 1.0679 -0.9581 N 0 0 0 0 0 -1.5138 3.0039 -1.6608 O 0 0 0 0 0 -4.6213 0.2246 -1.2475 C 0 0 0 0 0 -5.1484 0.8270 1.0377 C 0 0 0 0 0 -4.4428 -2.6092 -0.2825 C 0 0 0 0 0 1.8193 -1.2254 1.1209 C 0 0 0 0 0 3.4256 2.9764 -0.4600 N 0 0 0 0 0 5.1994 2.9359 1.3058 C 0 0 0 0 0 4.5383 3.7527 1.9112 O 0 0 0 0 0 6.3936 2.5436 1.7911 N 0 0 0 0 0 1.0477 -1.8087 2.1342 C 0 0 0 0 0 1.5936 -2.9483 2.4791 N 0 0 0 0 0 2.7437 -3.1629 1.7098 N 0 0 0 0 0 2.8866 -2.0985 0.8592 C 0 0 0 0 0 3.6543 -4.1844 1.6848 C 0 0 0 0 0 4.6902 -4.1247 0.8196 C 0 0 0 0 0 4.8110 -3.0081 -0.0402 C 0 0 0 0 0 3.9085 -2.0387 0.0040 N 0 0 0 0 0 5.9339 -2.9266 -0.9906 C 0 0 0 0 0 6.0976 -1.9646 -1.9256 C 0 0 0 0 0 7.2288 -2.1003 -2.6978 C 0 0 0 0 0 7.9924 -3.1603 -2.4067 C 0 0 0 0 0 7.2747 -4.0619 -1.0777 S 0 0 0 0 0 -4.0607 2.2718 -0.8826 H 0 0 0 0 0 -3.6310 1.6694 -2.5014 H 0 0 0 0 0 -6.7171 -0.2157 -1.4793 H 0 0 0 0 0 -6.3679 1.4562 -0.9785 H 0 0 0 0 0 -6.0758 0.9523 -2.6605 H 0 0 0 0 0 -5.4178 -1.6794 1.3977 H 0 0 0 0 0 -6.2504 -1.4441 -0.1582 H 0 0 0 0 0 -5.1094 -0.4835 2.7464 H 0 0 0 0 0 -3.6907 0.5809 2.6040 H 0 0 0 0 0 -5.2501 1.2448 3.1478 H 0 0 0 0 0 3.6841 3.8783 -2.4083 H 0 0 0 0 0 3.6835 2.0609 -2.4033 H 0 0 0 0 0 6.0320 2.3031 -1.7460 H 0 0 0 0 0 5.7435 3.9704 -1.0829 H 0 0 0 0 0 4.6682 1.2694 0.0097 H 0 0 0 0 0 7.8232 2.5949 3.3254 H 0 0 0 0 0 6.9049 4.1028 3.0978 H 0 0 0 0 0 6.1303 2.6958 3.8663 H 0 0 0 0 0 -0.5366 -0.3495 0.1444 H 0 0 0 0 0 0.9542 3.4227 -1.2627 H 0 0 0 0 0 -2.1928 0.2143 -0.5229 H 0 0 0 0 0 -4.3016 -0.5985 -1.8877 H 0 0 0 0 0 -4.7499 1.8023 0.7570 H 0 0 0 0 0 -6.2339 0.8358 0.9369 H 0 0 0 0 0 -4.2595 -2.3901 -1.3344 H 0 0 0 0 0 -3.4909 -2.6853 0.2439 H 0 0 0 0 0 -4.9811 -3.5529 -0.1969 H 0 0 0 0 0 6.9567 1.9488 1.2710 H 0 0 0 0 0 0.1488 -1.3884 2.5613 H 0 0 0 0 0 3.5451 -5.0280 2.3492 H 0 0 0 0 0 5.4186 -4.9218 0.7852 H 0 0 0 0 0 5.3957 -1.1544 -2.0572 H 0 0 0 0 0 7.4799 -1.4042 -3.4857 H 0 0 0 0 0 8.9123 -3.4199 -2.9087 H 0 0 0 0 0 3 19 1 0 0 0 20 5 1 0 0 0 20 2 1 0 0 0 37 38 2 0 0 0 37 36 1 0 0 0 38 39 1 0 0 0 4 2 1 0 0 0 4 21 1 0 0 0 2 19 1 0 0 0 19 1 1 0 0 0 36 35 2 0 0 0 39 35 1 0 0 0 1 17 1 0 0 0 35 33 1 0 0 0 17 16 1 0 0 0 33 32 1 0 0 0 33 34 2 0 0 0 18 16 2 0 0 0 16 11 1 0 0 0 32 31 2 0 0 0 34 30 1 0 0 0 11 10 2 0 0 0 11 12 1 0 0 0 10 15 1 0 0 0 31 29 1 0 0 0 30 29 1 0 0 0 30 22 2 0 0 0 12 13 2 0 0 0 29 28 1 0 0 0 15 22 1 0 0 0 15 14 2 0 0 0 22 27 1 0 0 0 9 26 1 0 0 0 25 24 2 0 0 0 13 14 1 0 0 0 13 23 1 0 0 0 28 27 2 0 0 0 26 24 1 0 0 0 24 8 1 0 0 0 23 8 1 0 0 0 23 6 1 0 0 0 8 7 1 0 0 0 6 7 1 0 0 0 1 40 1 0 0 0 1 41 1 0 0 0 3 42 1 0 0 0 3 43 1 0 0 0 3 44 1 0 0 0 4 45 1 0 0 0 4 46 1 0 0 0 5 47 1 0 0 0 5 48 1 0 0 0 5 49 1 0 0 0 6 50 1 0 0 0 6 51 1 0 0 0 7 52 1 0 0 0 7 53 1 0 0 0 8 54 1 0 0 0 9 55 1 0 0 0 9 56 1 0 0 0 9 57 1 0 0 0 10 58 1 0 0 0 12 59 1 0 0 0 17 60 1 0 0 0 19 61 1 0 0 0 20 62 1 0 0 0 20 63 1 0 0 0 21 64 1 0 0 0 21 65 1 0 0 0 21 66 1 0 0 0 26 67 1 0 0 0 27 68 1 0 0 0 31 69 1 0 0 0 32 70 1 0 0 0 36 71 1 0 0 0 37 72 1 0 0 0 38 73 1 0 0 0 M END $$$$