9CO Converted by convert_cif2sdf.py 2024/03/29 11:09:15 93103 0 0 0 0 0 0 0 0999 V2000 27.7943 23.5706 -16.3457 C 0 0 0 0 0 27.5898 23.1986 -15.1181 O 0 0 0 0 0 29.0142 23.2008 -17.0881 C 0 0 0 0 0 30.2704 23.4045 -16.1665 C 0 0 0 0 0 30.4337 24.8895 -15.7665 C 0 0 0 0 0 31.6342 24.9819 -14.8466 C 0 0 0 0 0 32.0551 26.4224 -14.4321 C 0 0 0 0 0 32.7567 27.4056 -15.7745 S 0 0 0 0 0 33.1233 28.7641 -14.6049 C 0 0 0 0 0 33.6666 28.0104 -13.3801 C 0 0 0 0 0 35.1536 27.7561 -13.4288 N 0 0 0 0 0 35.3042 26.4309 -13.4896 C 0 0 0 0 0 36.4789 25.8766 -13.6385 O 0 0 0 0 0 34.1581 25.6576 -13.3861 N 0 0 0 0 0 33.0322 26.5702 -13.2372 C 0 0 0 0 0 26.9011 24.3146 -17.0821 N 0 0 0 0 0 25.7260 24.9032 -16.3386 C 0 0 0 0 0 24.6307 23.9616 -16.6809 C 0 0 0 0 0 23.5563 24.1483 -15.5907 C 0 0 0 0 0 18.4461 25.5486 -15.2780 CO 0 0 0 0 0 19.1622 24.9918 -18.4030 C 0 0 0 0 0 19.9669 24.7792 -19.4744 C 0 0 0 0 0 21.2899 24.7540 -19.2803 C 0 0 0 0 0 21.7375 24.9647 -18.0215 C 0 0 0 0 0 20.9987 25.1961 -16.8655 C 0 0 0 0 0 21.5968 25.4377 -15.5490 C 0 0 0 0 0 21.1240 24.6240 -14.4233 C 0 0 0 0 0 21.9846 24.0689 -13.5710 C 0 0 0 0 0 21.5524 23.4393 -12.4792 C 0 0 0 0 0 20.2693 23.3864 -12.1672 C 0 0 0 0 0 19.4083 23.9979 -12.9411 C 0 0 0 0 0 18.1122 24.0794 -12.6724 C 0 0 0 0 0 17.5632 23.5382 -11.5678 C 0 0 0 0 0 16.2784 23.6455 -11.2399 C 0 0 0 0 0 15.4548 24.3140 -12.0205 C 0 0 0 0 0 15.9740 24.8451 -13.1254 C 0 0 0 0 0 21.3943 26.8910 -15.2865 C 0 0 0 0 0 22.3223 27.8965 -15.2213 C 0 0 0 0 0 21.8892 29.1839 -15.0374 C 0 0 0 0 0 20.5816 29.4669 -14.9967 C 0 0 0 0 0 19.6253 28.4917 -15.0561 C 0 0 0 0 0 18.1387 28.5551 -15.1415 C 0 0 0 0 0 17.4231 29.6323 -15.3438 C 0 0 0 0 0 16.0852 29.6460 -15.5163 C 0 0 0 0 0 15.3769 28.5446 -15.6283 C 0 0 0 0 0 16.0615 27.4392 -15.5489 C 0 0 0 0 0 19.6673 25.1995 -17.1436 N 0 0 0 0 0 20.0976 27.2761 -15.2027 N 0 0 0 0 0 17.3813 27.4813 -15.3695 N 0 0 0 0 0 17.2687 24.7248 -13.4568 N 0 0 0 0 0 19.8662 24.5710 -14.0218 N 0 0 0 0 0 23.0689 25.5124 -15.6096 O 0 0 0 0 0 16.9146 23.7485 -16.1108 O 0 0 0 0 0 28.9512 22.1466 -17.3948 H 0 0 0 0 0 29.1073 23.8370 -17.9806 H 0 0 0 0 0 30.1502 22.7983 -15.2560 H 0 0 0 0 0 31.1701 23.0771 -16.7082 H 0 0 0 0 0 30.5992 25.5047 -16.6632 H 0 0 0 0 0 29.5311 25.2393 -15.2433 H 0 0 0 0 0 31.4020 24.4205 -13.9292 H 0 0 0 0 0 32.4885 24.5133 -15.3566 H 0 0 0 0 0 31.1330 26.9555 -14.1567 H 0 0 0 0 0 33.8777 29.4505 -15.0167 H 0 0 0 0 0 32.2134 29.3289 -14.3530 H 0 0 0 0 0 33.4269 28.5859 -12.4734 H 0 0 0 0 0 35.8804 28.4421 -13.4181 H 0 0 0 0 0 34.1129 24.6591 -13.4097 H 0 0 0 0 0 32.5131 26.4596 -12.2739 H 0 0 0 0 0 27.0247 24.4586 -18.0640 H 0 0 0 0 0 25.5010 25.9205 -16.6911 H 0 0 0 0 0 25.9098 24.9230 -15.2546 H 0 0 0 0 0 25.0013 22.9258 -16.6790 H 0 0 0 0 0 24.2161 24.2010 -17.6718 H 0 0 0 0 0 22.7202 23.4589 -15.7800 H 0 0 0 0 0 23.9939 23.9310 -14.6058 H 0 0 0 0 0 18.0917 24.9979 -18.5457 H 0 0 0 0 0 19.5497 24.6342 -20.4599 H 0 0 0 0 0 21.9737 24.5730 -20.0967 H 0 0 0 0 0 22.8110 24.9518 -17.8971 H 0 0 0 0 0 23.0445 24.1302 -13.7675 H 0 0 0 0 0 22.2704 22.9593 -11.8311 H 0 0 0 0 0 19.9376 22.8496 -11.2912 H 0 0 0 0 0 18.2085 22.9808 -10.9048 H 0 0 0 0 0 15.9112 23.1851 -10.3345 H 0 0 0 0 0 14.4089 24.4263 -11.7767 H 0 0 0 0 0 15.3225 25.3988 -13.7857 H 0 0 0 0 0 23.3761 27.6785 -15.3136 H 0 0 0 0 0 22.6111 29.9795 -14.9241 H 0 0 0 0 0 20.2724 30.4982 -14.9145 H 0 0 0 0 0 17.9412 30.5791 -15.3747 H 0 0 0 0 0 15.5776 30.5981 -15.5640 H 0 0 0 0 0 14.3069 28.5554 -15.7758 H 0 0 0 0 0 15.5590 26.4869 -15.6290 H 0 0 0 0 0 34 35 2 0 0 0 34 33 1 0 0 0 35 36 1 0 0 0 33 32 2 0 0 0 36 50 2 0 0 0 32 50 1 0 0 0 32 31 1 0 0 0 50 20 1 0 0 0 30 31 2 0 0 0 30 29 1 0 0 0 31 51 1 0 0 0 29 28 2 0 0 0 51 20 1 0 0 0 51 27 2 0 0 0 20 47 1 0 0 0 20 49 1 0 0 0 20 48 1 0 0 0 46 45 2 0 0 0 46 49 1 0 0 0 28 27 1 0 0 0 21 47 2 0 0 0 21 22 1 0 0 0 27 26 1 0 0 0 45 44 1 0 0 0 47 25 1 0 0 0 49 42 2 0 0 0 22 23 2 0 0 0 25 26 1 0 0 0 25 24 2 0 0 0 26 52 1 0 0 0 26 37 1 0 0 0 23 24 1 0 0 0 19 18 1 0 0 0 19 52 1 0 0 0 44 43 2 0 0 0 42 43 1 0 0 0 42 41 1 0 0 0 48 37 2 0 0 0 48 41 1 0 0 0 18 17 1 0 0 0 37 38 1 0 0 0 41 40 2 0 0 0 2 1 2 0 0 0 17 16 1 0 0 0 1 16 1 0 0 0 1 3 1 0 0 0 38 39 2 0 0 0 40 39 1 0 0 0 3 4 1 0 0 0 4 5 1 0 0 0 5 6 1 0 0 0 6 7 1 0 0 0 7 15 1 0 0 0 7 8 1 0 0 0 14 15 1 0 0 0 14 12 1 0 0 0 15 10 1 0 0 0 8 9 1 0 0 0 12 13 2 0 0 0 12 11 1 0 0 0 10 9 1 0 0 0 10 11 1 0 0 0 20 53 1 0 0 0 3 54 1 0 0 0 3 55 1 0 0 0 4 56 1 0 0 0 4 57 1 0 0 0 5 58 1 0 0 0 5 59 1 0 0 0 6 60 1 0 0 0 6 61 1 0 0 0 7 62 1 0 0 0 9 63 1 0 0 0 9 64 1 0 0 0 10 65 1 0 0 0 11 66 1 0 0 0 14 67 1 0 0 0 15 68 1 0 0 0 16 69 1 0 0 0 17 70 1 0 0 0 17 71 1 0 0 0 18 72 1 0 0 0 18 73 1 0 0 0 19 74 1 0 0 0 19 75 1 0 0 0 21 76 1 0 0 0 22 77 1 0 0 0 23 78 1 0 0 0 24 79 1 0 0 0 28 80 1 0 0 0 29 81 1 0 0 0 30 82 1 0 0 0 33 83 1 0 0 0 34 84 1 0 0 0 35 85 1 0 0 0 36 86 1 0 0 0 38 87 1 0 0 0 39 88 1 0 0 0 40 89 1 0 0 0 43 90 1 0 0 0 44 91 1 0 0 0 45 92 1 0 0 0 46 93 1 0 0 0 M END $$$$