HMDB0257069 RDKit 3D r-(+)-bisoprolol 54 54 0 0 0 0 0 0 0 0999 V2000 7.0369 -1.1437 0.0093 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6089 0.0136 -0.8962 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9326 0.3250 -1.6715 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2952 1.1770 -0.2118 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2911 1.3505 0.7094 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8524 1.3989 0.3176 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1506 1.5975 1.5352 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2979 0.2087 -0.3751 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9933 0.2052 -0.6646 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7483 0.2015 -0.1994 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2780 0.2388 -1.1677 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5835 0.2347 -0.7655 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9676 0.1956 0.5514 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3698 0.1943 1.0007 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9827 -1.0562 0.9642 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1259 -1.6180 -0.2604 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0654 -0.9870 -1.2258 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3792 -0.9272 -0.9006 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.8340 -0.2994 0.1984 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6402 -1.3204 1.0231 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8223 0.8043 -0.2753 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9602 0.1579 1.5122 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3547 0.1617 1.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6447 -0.6677 0.8109 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6020 -1.8424 -0.6353 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2044 -1.6785 0.4544 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9566 -0.3794 -1.6824 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5833 0.8495 -0.9436 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3132 -0.6342 -2.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6260 0.9619 -2.5265 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1319 1.7955 -0.0743 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4825 2.3404 1.2528 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3239 0.6279 1.5862 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6419 2.2896 -0.3519 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5695 0.9554 2.1776 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8459 0.1194 -1.3874 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5671 -0.7417 0.1982 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0347 0.2684 -2.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3916 0.2675 -1.5074 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4154 0.5337 2.0538 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9356 0.9572 0.4212 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1502 -1.8671 -0.7715 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5531 -2.6561 -0.0679 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0057 -1.5572 -2.2057 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7567 0.0622 -1.4983 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1201 0.1660 0.8665 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5792 -1.5836 0.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9902 -2.1784 1.2159 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9029 -0.8539 2.0059 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3073 1.3023 -1.1198 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0005 1.5126 0.5751 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7282 0.2804 -0.6078 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2654 0.1267 2.5642 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0908 0.1103 1.8899 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 2 4 1 0 4 5 1 0 5 6 1 0 6 7 1 0 6 8 1 0 8 9 1 0 9 10 1 0 10 11 2 0 11 12 1 0 12 13 2 0 13 14 1 0 14 15 1 0 15 16 1 0 16 17 1 0 17 18 1 0 18 19 1 0 19 20 1 0 19 21 1 0 13 22 1 0 22 23 2 0 23 10 1 0 1 24 1 0 1 25 1 0 1 26 1 0 2 27 1 0 3 28 1 0 3 29 1 0 3 30 1 0 4 31 1 0 5 32 1 0 5 33 1 0 6 34 1 0 7 35 1 0 8 36 1 0 8 37 1 0 11 38 1 0 12 39 1 0 14 40 1 0 14 41 1 0 16 42 1 0 16 43 1 0 17 44 1 0 17 45 1 0 19 46 1 0 20 47 1 0 20 48 1 0 20 49 1 0 21 50 1 0 21 51 1 0 21 52 1 0 22 53 1 0 23 54 1 0 M END