HMDB0000241 RDKit 3D Protoporphyrin IX 76 80 0 0 0 0 0 0 0 0999 V2000 -3.8863 5.2800 0.4954 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5612 4.2188 0.1914 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1359 2.8470 0.1725 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8898 1.8121 -0.1711 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3027 1.8632 -0.6012 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1247 0.5941 -0.0686 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3203 -0.7664 -0.2996 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3237 -1.7623 -0.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1005 -1.7563 -0.8661 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5357 -2.9419 -0.6086 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2774 -3.4596 -0.9245 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9587 -2.8172 -0.8415 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0215 -1.5951 -0.2991 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2855 -1.1078 -0.2920 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4553 0.1788 0.2193 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4724 1.1752 0.3796 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1785 1.0899 0.7174 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3094 2.3424 0.7001 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6072 2.8216 0.9690 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8168 2.3126 0.5236 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9074 0.9732 0.3496 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7001 3.2640 0.3439 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6068 4.7675 0.2178 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8237 2.5132 0.1434 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1586 3.1083 -0.2335 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0864 3.2689 0.9161 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3469 3.8694 0.3790 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1804 3.1129 -0.1763 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6422 5.2128 0.4610 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1192 -2.1297 -0.8927 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5507 -2.0862 -1.1692 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4573 -2.3649 -0.0254 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4047 -1.5069 1.1378 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0125 -0.3950 1.2399 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6542 -1.8744 2.2480 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3114 -3.1577 -1.2238 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7642 -4.4113 -1.8718 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4484 -3.7406 0.1252 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2352 -5.1491 0.6430 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5931 -3.0070 0.3110 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8032 -3.4078 1.0205 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1934 -4.6495 1.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8867 5.3237 0.7866 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3969 6.2627 0.4509 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6300 4.3739 -0.0956 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3989 1.8000 -1.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8936 1.0052 -0.2032 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8491 2.7670 -0.2653 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3820 -1.0410 -0.4533 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6323 -0.9213 -1.4524 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1450 -4.5105 -1.2734 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5059 0.3600 0.4801 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3822 0.1633 0.9850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7337 3.7182 1.6108 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1162 5.0464 -0.7298 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0183 5.0991 1.0713 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6112 5.1678 0.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6146 2.4336 -0.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9995 4.0810 -0.7393 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6950 3.9536 1.7014 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3595 2.3380 1.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9885 5.9535 0.2748 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7997 -1.0917 -1.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7891 -2.8460 -1.9756 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3003 -3.4311 0.3516 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5364 -2.3779 -0.3675 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9507 -2.5908 2.8996 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9313 -5.0461 -2.1898 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3892 -4.2228 -2.7688 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4425 -4.9313 -1.1379 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6903 -5.1935 1.6359 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5019 -5.9125 -0.0789 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1136 -5.2138 0.8192 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3686 -2.6629 1.5334 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7050 -5.4660 0.5603 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1203 -4.9273 1.5861 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 3 2 3 1 0 3 4 2 0 4 5 1 0 4 6 1 0 6 7 2 0 7 8 1 0 8 9 1 0 9 10 1 0 10 11 1 0 11 12 2 0 12 13 1 0 13 14 2 0 14 15 1 0 15 16 2 0 16 17 1 0 17 18 1 0 18 19 2 0 19 20 1 0 20 21 2 0 18 22 1 0 22 23 1 0 22 24 2 0 24 25 1 0 25 26 1 0 26 27 1 0 27 28 2 0 27 29 1 0 14 30 1 0 30 31 1 0 31 32 1 0 32 33 1 0 33 34 2 0 33 35 1 0 30 36 2 0 36 37 1 0 10 38 2 0 38 39 1 0 38 40 1 0 40 41 1 0 41 42 2 3 20 3 1 0 21 6 1 0 40 8 2 0 36 12 1 0 24 16 1 0 1 43 1 0 1 44 1 0 2 45 1 0 5 46 1 0 5 47 1 0 5 48 1 0 7 49 1 0 9 50 1 0 11 51 1 0 15 52 1 0 17 53 1 0 19 54 1 0 23 55 1 0 23 56 1 0 23 57 1 0 25 58 1 0 25 59 1 0 26 60 1 0 26 61 1 0 29 62 1 0 31 63 1 0 31 64 1 0 32 65 1 0 32 66 1 0 35 67 1 0 37 68 1 0 37 69 1 0 37 70 1 0 39 71 1 0 39 72 1 0 39 73 1 0 41 74 1 0 42 75 1 0 42 76 1 0 M END