@MOLECULE DN 23 23 0 0 0 SMALL GASTEIGER @ATOM 1 O 3.3700 -0.7960 -0.9810 O.3 1 UNL1 -0.3026 2 P 2.4130 -0.0070 0.0460 P.3 1 UNL1 0.4724 3 O 2.5570 -0.5880 1.4000 O.2 1 UNL1 -0.2275 4 O 2.8310 1.5470 0.0820 O.3 1 UNL1 -0.3026 5 O 0.8830 -0.1410 -0.4360 O.3 1 UNL1 -0.2841 6 C -0.2190 0.3630 0.3220 C.3 1 UNL1 0.0877 7 C -1.5250 0.0690 -0.4190 C.3 1 UNL1 0.1083 8 O -1.7520 -1.3440 -0.4620 O.3 1 UNL1 -0.3716 9 C -2.7100 0.7110 0.3340 C.3 1 UNL1 0.0856 10 O -3.1100 1.9310 -0.2920 O.3 1 UNL1 -0.3891 11 C -3.8150 -0.3720 0.1920 C.3 1 UNL1 -0.0008 12 C -2.9650 -1.6670 0.2370 C.3 1 UNL1 0.0507 13 H 4.3090 -0.7580 -0.7520 H 1 UNL1 0.2220 14 H 2.7610 1.9930 -0.7730 H 1 UNL1 0.2220 15 H -0.2390 -0.1200 1.2990 H 1 UNL1 0.0592 16 H -0.1080 1.4390 0.4510 H 1 UNL1 0.0592 17 H -1.4710 0.4660 -1.4330 H 1 UNL1 0.0645 18 H -2.4590 0.8780 1.3810 H 1 UNL1 0.0620 19 H -3.8520 2.3720 0.1440 H 1 UNL1 0.2099 20 H -4.5140 -0.3310 1.0270 H 1 UNL1 0.0313 21 H -3.4880 -2.4800 -0.2680 H 1 UNL1 0.0561 22 H -2.7460 -1.9400 1.2690 H 1 UNL1 0.0561 23 H -4.3370 -0.2770 -0.7600 H 1 UNL1 0.0313 @BOND 1 1 2 1 2 1 13 1 3 2 3 2 4 2 4 1 5 2 5 1 6 4 14 1 7 5 6 1 8 6 7 1 9 6 15 1 10 6 16 1 11 7 8 1 12 7 9 1 13 7 17 1 14 8 12 1 15 9 10 1 16 9 11 1 17 9 18 1 18 10 19 1 19 11 23 1 20 11 12 1 21 11 20 1 22 12 21 1 23 12 22 1