HMDB0028703 RDKit 3D Arginylarginine 49 48 0 0 0 0 0 0 0 0999 V2000 7.6696 -0.8840 0.0861 N 0 0 0 0 0 0 0 0 0 0 0 0 7.3631 0.2825 -0.3177 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2170 1.3708 -0.0674 N 0 0 0 0 0 0 0 0 0 0 0 0 6.1502 0.4715 -1.0236 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8859 -0.0374 -0.4668 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7395 0.2694 -1.3675 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4113 -0.2105 -0.9309 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8877 0.2898 0.3656 C 0 0 2 0 0 0 0 0 0 0 0 0 2.7120 -0.0408 1.5019 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5124 -0.2441 0.5474 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2238 -0.9066 1.5775 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4822 -0.0239 -0.4131 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8416 -0.5118 -0.3047 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.7409 0.6989 -0.3363 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1929 0.3814 -0.2336 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4830 -0.3377 1.0632 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9055 -0.6181 1.0999 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.8109 0.4458 1.2205 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6610 1.3365 2.1258 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.9203 0.5291 0.3096 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1141 -1.4607 -1.3842 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2147 -1.7221 -2.2182 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3322 -2.1113 -1.5562 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1159 -1.7463 -0.0446 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9016 2.3698 -0.0237 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2447 1.2279 0.0922 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1474 0.9679 -1.9337 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0326 -1.1223 -0.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7144 0.5130 0.5059 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6901 1.3419 -1.6555 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9634 -0.2549 -2.3467 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6753 0.1065 -1.7255 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3558 -1.3253 -0.9590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7789 1.3980 0.3466 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4160 0.4056 2.3721 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8196 -1.0769 1.5785 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2537 0.5246 -1.2674 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9055 -1.0567 0.6579 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4608 1.3386 0.5331 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5004 1.2769 -1.2417 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7424 1.3437 -0.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5324 -0.1596 -1.1135 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2766 0.3391 1.9293 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8587 -1.2315 1.2197 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2699 -1.6067 1.0373 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8716 1.2810 2.7771 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5363 -0.3228 0.1842 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0959 1.4076 -0.2011 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6243 -2.9058 -1.0071 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 3 2 3 1 0 2 4 1 0 4 5 1 0 5 6 1 0 6 7 1 0 7 8 1 0 8 9 1 0 8 10 1 0 10 11 2 0 10 12 1 0 12 13 1 0 13 14 1 0 14 15 1 0 15 16 1 0 16 17 1 0 17 18 1 0 18 19 2 3 18 20 1 0 13 21 1 0 21 22 2 0 21 23 1 0 1 24 1 0 3 25 1 0 3 26 1 0 4 27 1 0 5 28 1 0 5 29 1 0 6 30 1 0 6 31 1 0 7 32 1 0 7 33 1 0 8 34 1 6 9 35 1 0 9 36 1 0 12 37 1 0 13 38 1 1 14 39 1 0 14 40 1 0 15 41 1 0 15 42 1 0 16 43 1 0 16 44 1 0 17 45 1 0 19 46 1 0 20 47 1 0 20 48 1 0 23 49 1 0 M END