@MOLECULE DB05273 41 40 1 SMALL USER_CHARGES @ATOM 1 P1 3.2246 -0.3726 -2.5237 P 1 noname 0.0210 2 O1 4.3296 -1.0664 -3.1331 O.2 1 noname -0.2266 3 O2 2.6110 0.6083 -3.5400 O.3 1 noname -0.1915 4 O3 3.7241 0.4082 -1.2938 O.3 1 noname -0.1915 5 C1 2.0808 -1.4652 -2.0542 C.3 1 noname 0.1066 6 N1 0.9589 -0.7608 -1.4354 N.3 1 noname -0.2841 7 C2 -0.0546 -1.7289 -1.0194 C.3 1 noname 0.0637 8 C3 1.4332 -0.0196 -0.2679 C.3 1 noname 0.0120 9 P2 -0.5898 -2.5654 -2.3371 P 1 noname -0.1393 10 C4 0.2592 0.7176 0.3796 C.3 1 noname 0.0114 11 O4 -1.5880 -3.5189 -1.9274 O.2 1 noname -0.3588 12 O5 -1.2034 -1.5845 -3.3534 O.3 1 noname -0.3856 13 O6 0.5919 -3.3074 -2.9888 O.3 1 noname -0.3588 14 N2 0.7334 1.4588 1.5471 N.3 1 noname -0.2916 15 C5 -0.3884 2.1632 2.1658 C.3 1 noname 0.0631 16 C6 1.3159 0.5276 2.5120 C.3 1 noname 0.0631 17 P3 -1.0459 3.2141 1.0769 P 1 noname -0.1393 18 P4 1.8511 1.3641 3.8296 P 1 noname -0.1393 19 O7 -2.1508 3.9079 1.6863 O.2 1 noname -0.3589 20 O8 0.0217 4.2339 0.6387 O.3 1 noname -0.3856 21 O9 -1.5454 2.4334 -0.1529 O.3 1 noname -0.3589 22 O10 2.4249 0.4469 4.7800 O.2 1 noname -0.3589 23 O11 2.9187 2.3838 3.3914 O.3 1 noname -0.3856 24 O12 0.6694 2.1060 4.4814 O.3 1 noname -0.3589 25 H1 2.1667 1.3185 -3.0711 H 1 noname 0.2260 26 H2 4.0006 -0.2098 -0.6131 H 1 noname 0.2260 27 H3 1.6563 -1.9331 -2.9424 H 1 noname 0.0585 28 H4 2.4919 -2.0834 -1.2561 H 1 noname 0.0585 29 H5 0.4748 -2.4153 -0.3586 H 1 noname 0.0484 30 H6 -0.8730 -1.1219 -0.6323 H 1 noname 0.0484 31 H7 1.7825 -0.7693 0.4421 H 1 noname 0.0444 32 H8 2.1233 0.7327 -0.6499 H 1 noname 0.0444 33 H9 -0.0902 1.4672 -0.3304 H 1 noname 0.0443 34 H10 -0.4310 -0.0347 0.7616 H 1 noname 0.0443 35 H11 -1.6477 -0.8743 -2.8846 H 1 noname 0.1785 36 H12 -1.1170 1.3826 2.3848 H 1 noname 0.0484 37 H13 0.0594 2.7342 2.9791 H 1 noname 0.0484 38 H14 0.4859 -0.1110 2.8144 H 1 noname 0.0484 39 H15 2.1745 0.0975 1.9962 H 1 noname 0.0484 40 H16 0.4298 4.6236 1.4154 H 1 noname 0.1785 41 H17 3.3268 2.7736 4.1681 H 1 noname 0.1785 @BOND 1 1 2 2 2 1 3 1 3 1 4 1 4 1 5 1 5 5 6 1 6 6 7 1 7 6 8 1 8 7 9 1 9 8 10 1 10 9 11 2 11 9 12 1 12 9 13 1 13 10 14 1 14 14 15 1 15 14 16 1 16 15 17 1 17 16 18 1 18 17 19 2 19 17 20 1 20 17 21 1 21 18 22 2 22 18 23 1 23 18 24 1 24 3 25 1 25 4 26 1 26 5 27 1 27 5 28 1 28 7 29 1 29 7 30 1 30 8 31 1 31 8 32 1 32 10 33 1 33 10 34 1 34 12 35 1 35 15 36 1 36 15 37 1 37 16 38 1 38 16 39 1 39 20 40 1 40 23 41 1 @SUBSTRUCTURE 1 noname 1