LP3 Converted by convert_cif2sdf.py 2024/03/29 11:09:15 90 89 0 0 0 0 0 0 0 0999 V2000 10.0479 0.5641 0.0712 C 0 0 0 0 0 8.8008 -0.3225 0.0855 C 0 0 0 0 0 7.5534 0.5505 -0.0588 C 0 0 0 0 0 14.8644 0.8935 0.7680 C 0 0 0 0 0 16.1624 0.1801 1.1511 C 0 0 0 0 0 16.6470 0.0298 -1.1931 C 0 0 0 0 0 17.8768 -1.3064 0.3740 C 0 0 0 0 0 15.5706 -1.7975 -0.0712 C 0 0 0 0 0 5.1483 0.2797 -0.0180 C 0 0 0 0 0 3.9165 -0.5783 0.1190 C 0 0 0 0 0 2.6681 0.2947 -0.0253 C 0 0 0 0 0 1.4184 -0.5758 0.1143 C 0 0 0 0 0 0.1700 0.2972 -0.0290 C 0 0 0 0 0 -1.0807 -0.5733 0.1107 C 0 0 0 0 0 -2.3281 0.2997 -0.0336 C 0 0 0 0 0 -3.5788 -0.5708 0.1060 C 0 0 0 0 0 -4.8272 0.3023 -0.0383 C 0 0 0 0 0 -6.0769 -0.5692 0.1013 C 0 0 0 0 0 -7.3253 0.3038 -0.0430 C 0 0 0 0 0 -8.5760 -0.5667 0.0966 C 0 0 0 0 0 -9.8244 0.3064 -0.0477 C 0 0 0 0 0 -11.0741 -0.5641 0.0920 C 0 0 0 0 0 -12.3225 0.3088 -0.0513 C 0 0 0 0 0 -13.5722 -0.5626 0.0872 C 0 0 0 0 0 -14.8206 0.3104 -0.0561 C 0 0 0 0 0 -16.0713 -0.5602 0.0835 C 0 0 0 0 0 16.5644 -0.7236 0.0657 N 0 3 0 0 0 8.8630 -1.2492 -1.0005 O 0 0 0 0 0 6.3664 -0.2755 0.0736 O 0 0 0 0 0 5.0387 1.4670 -0.2111 O 0 0 0 0 0 12.6462 1.3610 -1.1892 O 0 0 0 0 0 12.2584 1.8598 1.2538 O 0 0 0 0 0 11.2052 -0.2363 0.3222 O 0 0 0 0 0 13.8012 -0.0592 0.6977 O 0 0 0 0 0 12.4725 0.7558 0.2917 P 0 0 0 0 0 10.1423 1.0428 -0.9034 H 0 0 0 0 0 9.9604 1.3279 0.8437 H 0 0 0 0 0 8.7550 -0.8698 1.0270 H 0 0 0 0 0 7.5549 1.0289 -1.0377 H 0 0 0 0 0 7.5519 1.3145 0.7191 H 0 0 0 0 0 14.9868 1.3740 -0.2023 H 0 0 0 0 0 14.6281 1.6462 1.5196 H 0 0 0 0 0 16.9468 0.9184 1.3189 H 0 0 0 0 0 16.0050 -0.3953 2.0642 H 0 0 0 0 0 17.3832 0.8268 -1.0919 H 0 0 0 0 0 16.9449 -0.6403 -1.9994 H 0 0 0 0 0 15.6725 0.4625 -1.4222 H 0 0 0 0 0 17.8161 -1.8660 1.3071 H 0 0 0 0 0 18.1747 -1.9775 -0.4324 H 0 0 0 0 0 18.6140 -0.5093 0.4742 H 0 0 0 0 0 14.6501 -1.3892 -0.4876 H 0 0 0 0 0 15.9596 -2.5691 -0.7348 H 0 0 0 0 0 15.3667 -2.2295 0.9088 H 0 0 0 0 0 3.9140 -1.0568 1.0989 H 0 0 0 0 0 3.9170 -1.3424 -0.6579 H 0 0 0 0 0 2.6706 0.7731 -1.0043 H 0 0 0 0 0 2.6676 1.0587 0.7525 H 0 0 0 0 0 1.4159 -1.0543 1.0942 H 0 0 0 0 0 1.4189 -1.3399 -0.6625 H 0 0 0 0 0 0.1725 0.7757 -1.0089 H 0 0 0 0 0 0.1695 1.0613 0.7479 H 0 0 0 0 0 -1.0822 -1.0517 1.0896 H 0 0 0 0 0 -1.0792 -1.3373 -0.6672 H 0 0 0 0 0 -2.3266 0.7782 -1.0136 H 0 0 0 0 0 -2.3296 1.0638 0.7432 H 0 0 0 0 0 -3.5813 -1.0492 1.0849 H 0 0 0 0 0 -3.5783 -1.3348 -0.6718 H 0 0 0 0 0 -4.8247 0.7797 -1.0173 H 0 0 0 0 0 -4.8277 1.0653 0.7395 H 0 0 0 0 0 -6.0794 -1.0476 1.0802 H 0 0 0 0 0 -6.0764 -1.3332 -0.6766 H 0 0 0 0 0 -7.3238 0.7822 -1.0220 H 0 0 0 0 0 -7.3258 1.0678 0.7348 H 0 0 0 0 0 -8.5775 -1.0452 1.0765 H 0 0 0 0 0 -8.5755 -1.3307 -0.6812 H 0 0 0 0 0 -9.8219 0.7848 -1.0266 H 0 0 0 0 0 -9.8249 1.0704 0.7302 H 0 0 0 0 0 -11.0766 -1.0426 1.0719 H 0 0 0 0 0 -11.0736 -1.3282 -0.6849 H 0 0 0 0 0 -12.3200 0.7873 -1.0313 H 0 0 0 0 0 -12.3230 1.0729 0.7255 H 0 0 0 0 0 -13.5747 -1.0401 1.0672 H 0 0 0 0 0 -13.5717 -1.3257 -0.6895 H 0 0 0 0 0 -14.8191 0.7888 -1.0360 H 0 0 0 0 0 -14.8221 1.0744 0.7208 H 0 0 0 0 0 -16.9609 0.0623 -0.0191 H 0 0 0 0 0 -16.0708 -1.3241 -0.6943 H 0 0 0 0 0 -16.0738 -1.0385 1.0625 H 0 0 0 0 0 8.9014 -0.7254 -1.8127 H 0 0 0 0 0 12.7838 0.6104 -1.7842 H 0 0 0 0 0 1 2 1 0 0 0 1 33 1 0 0 0 1 36 1 0 0 0 1 37 1 0 0 0 2 3 1 0 0 0 2 28 1 0 0 0 2 38 1 0 0 0 3 29 1 0 0 0 3 39 1 0 0 0 3 40 1 0 0 0 4 5 1 0 0 0 4 34 1 0 0 0 4 41 1 0 0 0 4 42 1 0 0 0 5 27 1 0 0 0 5 43 1 0 0 0 5 44 1 0 0 0 6 27 1 0 0 0 6 45 1 0 0 0 6 46 1 0 0 0 6 47 1 0 0 0 7 27 1 0 0 0 7 48 1 0 0 0 7 49 1 0 0 0 7 50 1 0 0 0 8 27 1 0 0 0 8 51 1 0 0 0 8 52 1 0 0 0 8 53 1 0 0 0 9 10 1 0 0 0 9 29 1 0 0 0 9 30 2 0 0 0 10 11 1 0 0 0 10 54 1 0 0 0 10 55 1 0 0 0 11 12 1 0 0 0 11 56 1 0 0 0 11 57 1 0 0 0 12 13 1 0 0 0 12 58 1 0 0 0 12 59 1 0 0 0 13 14 1 0 0 0 13 60 1 0 0 0 13 61 1 0 0 0 14 15 1 0 0 0 14 62 1 0 0 0 14 63 1 0 0 0 15 16 1 0 0 0 15 64 1 0 0 0 15 65 1 0 0 0 16 17 1 0 0 0 16 66 1 0 0 0 16 67 1 0 0 0 17 18 1 0 0 0 17 68 1 0 0 0 17 69 1 0 0 0 18 19 1 0 0 0 18 70 1 0 0 0 18 71 1 0 0 0 19 20 1 0 0 0 19 72 1 0 0 0 19 73 1 0 0 0 20 21 1 0 0 0 20 74 1 0 0 0 20 75 1 0 0 0 21 22 1 0 0 0 21 76 1 0 0 0 21 77 1 0 0 0 22 23 1 0 0 0 22 78 1 0 0 0 22 79 1 0 0 0 23 24 1 0 0 0 23 80 1 0 0 0 23 81 1 0 0 0 24 25 1 0 0 0 24 82 1 0 0 0 24 83 1 0 0 0 25 26 1 0 0 0 25 84 1 0 0 0 25 85 1 0 0 0 26 86 1 0 0 0 26 87 1 0 0 0 26 88 1 0 0 0 28 89 1 0 0 0 31 35 1 0 0 0 31 90 1 0 0 0 32 35 2 0 0 0 33 35 1 0 0 0 34 35 1 0 0 0 M END $$$$