CWQ Converted by convert_cif2sdf.py 2024/03/29 11:09:15 72 76 0 0 0 0 0 0 0 0999 V2000 -3.4520 2.9516 -1.7387 C 0 0 0 0 0 -2.5395 1.4849 -0.0741 C 0 0 0 0 0 -2.5959 1.0985 1.4053 C 0 0 0 0 0 -0.3068 0.2873 2.1417 C 0 0 0 0 0 0.6315 0.4723 0.9482 C 0 0 0 0 0 0.7495 -0.8484 0.1812 C 0 0 0 0 0 1.7369 -0.6712 -0.9759 C 0 0 0 0 0 3.0896 -0.2185 -0.4203 C 0 0 0 0 0 4.2226 1.5838 0.7310 C 0 0 0 0 0 5.1048 1.9230 -0.4885 C 0 0 0 0 0 5.9164 0.6727 -0.7512 C 0 0 0 0 0 6.6254 0.2822 -1.8759 C 0 0 0 0 0 7.3015 -0.9214 -1.8876 C 0 0 0 0 0 7.2717 -1.7403 -0.7733 C 0 0 0 0 0 6.5658 -1.3528 0.3485 C 0 0 0 0 0 5.8876 -0.1452 0.3621 C 0 0 0 0 0 5.0518 0.5008 1.4534 C 0 0 0 0 0 2.0162 0.8920 1.4474 C 0 0 0 0 0 -2.7228 3.8363 0.3689 C 0 0 0 0 0 -2.0443 -1.2742 1.4483 C 0 0 0 0 0 -3.3736 -1.5601 0.8598 C 0 0 0 0 0 -5.4317 -0.7793 0.1580 C 0 0 0 0 0 -5.8205 -2.0898 -0.2251 C 0 0 0 0 0 -4.9200 -3.1544 -0.0353 C 0 0 0 0 0 -3.6984 -2.8791 0.5078 C 0 0 0 0 0 -6.3384 0.2880 -0.0338 C 0 0 0 0 0 -7.5650 0.0405 -0.5798 C 0 0 0 0 0 -7.9394 -1.2480 -0.9520 C 0 0 0 0 0 -7.0918 -2.3003 -0.7827 C 0 0 0 0 0 -3.3535 2.6876 -0.2970 N 0 3 0 0 0 -1.6599 0.0005 1.6587 N 0 0 0 0 0 2.9236 1.0477 0.3026 N 0 0 0 0 0 -4.2272 -0.5694 0.6829 N 0 0 0 0 0 -1.3001 -2.1894 1.7405 O 0 0 0 0 0 -5.9924 1.5509 0.3250 O 0 0 0 0 0 -3.9195 2.1008 -2.2331 H 0 0 0 0 0 -4.0557 3.8447 -1.9036 H 0 0 0 0 0 -2.4542 3.1075 -2.1485 H 0 0 0 0 0 -1.5067 1.6879 -0.3574 H 0 0 0 0 0 -2.9284 0.6667 -0.6785 H 0 0 0 0 0 -2.3215 1.9588 2.0162 H 0 0 0 0 0 -3.6072 0.7800 1.6595 H 0 0 0 0 0 0.0437 -0.5428 2.7556 H 0 0 0 0 0 -0.3208 1.1997 2.7383 H 0 0 0 0 0 0.2341 1.2419 0.2875 H 0 0 0 0 0 1.1104 -1.6279 0.8520 H 0 0 0 0 0 -0.2276 -1.1291 -0.2122 H 0 0 0 0 0 1.8577 -1.6200 -1.4991 H 0 0 0 0 0 1.3564 0.0808 -1.6673 H 0 0 0 0 0 3.4750 -0.9777 0.2592 H 0 0 0 0 0 3.7910 -0.0781 -1.2432 H 0 0 0 0 0 4.0887 2.4584 1.3684 H 0 0 0 0 0 4.4829 2.1580 -1.3522 H 0 0 0 0 0 5.7634 2.7618 -0.2585 H 0 0 0 0 0 6.6486 0.9209 -2.7459 H 0 0 0 0 0 7.8524 -1.2241 -2.7654 H 0 0 0 0 0 7.8005 -2.6827 -0.7811 H 0 0 0 0 0 6.5436 -1.9925 1.2175 H 0 0 0 0 0 5.6969 0.9544 2.2060 H 0 0 0 0 0 4.3950 -0.2375 1.9142 H 0 0 0 0 0 1.9376 1.8397 1.9808 H 0 0 0 0 0 2.4076 0.1287 2.1189 H 0 0 0 0 0 -2.6495 3.6403 1.4390 H 0 0 0 0 0 -1.7250 3.9911 -0.0409 H 0 0 0 0 0 -3.3264 4.7284 0.2040 H 0 0 0 0 0 -5.1863 -4.1631 -0.3163 H 0 0 0 0 0 -2.9843 -3.6733 0.6657 H 0 0 0 0 0 -8.2566 0.8580 -0.7241 H 0 0 0 0 0 -8.9152 -1.4150 -1.3820 H 0 0 0 0 0 -7.3959 -3.2939 -1.0766 H 0 0 0 0 0 -5.6626 2.0908 -0.4070 H 0 0 0 0 0 -4.2772 2.5443 0.0829 H 0 0 0 0 0 14 15 2 0 0 0 14 13 1 0 0 0 15 16 1 0 0 0 13 12 2 0 0 0 16 17 1 0 0 0 16 11 2 0 0 0 12 11 1 0 0 0 17 9 1 0 0 0 11 10 1 0 0 0 10 9 1 0 0 0 9 32 1 0 0 0 8 32 1 0 0 0 8 7 1 0 0 0 32 18 1 0 0 0 7 6 1 0 0 0 18 5 1 0 0 0 6 5 1 0 0 0 5 4 1 0 0 0 4 31 1 0 0 0 34 20 2 0 0 0 31 20 1 0 0 0 31 3 1 0 0 0 20 21 1 0 0 0 3 2 1 0 0 0 2 30 1 0 0 0 21 25 2 0 0 0 21 33 1 0 0 0 25 24 1 0 0 0 19 30 1 0 0 0 30 1 1 0 0 0 33 22 2 0 0 0 24 23 2 0 0 0 22 23 1 0 0 0 22 26 1 0 0 0 23 29 1 0 0 0 35 26 1 0 0 0 26 27 2 0 0 0 29 28 2 0 0 0 27 28 1 0 0 0 1 36 1 0 0 0 1 37 1 0 0 0 1 38 1 0 0 0 2 39 1 0 0 0 2 40 1 0 0 0 3 41 1 0 0 0 3 42 1 0 0 0 4 43 1 0 0 0 4 44 1 0 0 0 5 45 1 0 0 0 6 46 1 0 0 0 6 47 1 0 0 0 7 48 1 0 0 0 7 49 1 0 0 0 8 50 1 0 0 0 8 51 1 0 0 0 9 52 1 0 0 0 10 53 1 0 0 0 10 54 1 0 0 0 12 55 1 0 0 0 13 56 1 0 0 0 14 57 1 0 0 0 15 58 1 0 0 0 17 59 1 0 0 0 17 60 1 0 0 0 18 61 1 0 0 0 18 62 1 0 0 0 19 63 1 0 0 0 19 64 1 0 0 0 19 65 1 0 0 0 24 66 1 0 0 0 25 67 1 0 0 0 27 68 1 0 0 0 28 69 1 0 0 0 29 70 1 0 0 0 35 71 1 0 0 0 30 72 1 0 0 0 M END $$$$