@MOLECULE triethyl thiophosphate 26 25 0 0 0 SMALL USER_CHARGES @ATOM 1 S -1.5559 0.7387 0.5004 S.3 1 UNL111111 0.1116 2 P 0.1430 0.3001 -0.6917 P.3 1 UNL111111 0.1937 3 O 0.5109 -1.0526 0.0844 O.3 1 UNL111111 -0.3531 4 O 1.2686 1.3919 -0.3721 O.3 1 UNL111111 -0.2626 5 O 0.0625 0.2350 -2.1536 O.2 1 UNL111111 -0.2788 6 C -2.8682 -0.4854 -0.0287 C.3 1 UNL111111 -0.2558 7 C 1.5292 -1.9813 -0.3450 C.3 1 UNL111111 0.0178 8 C 1.8308 1.6708 0.9254 C.3 1 UNL111111 -0.0052 9 C -4.1369 -0.0954 0.7087 C.3 1 UNL111111 -0.4365 10 C 1.4604 -3.0215 0.7753 C.3 1 UNL111111 -0.4667 11 C 3.2596 1.1312 0.9282 C.3 1 UNL111111 -0.4733 12 H -3.0280 -0.4599 -1.1242 H 1 UNL111111 0.1658 13 H -2.5606 -1.5160 0.2309 H 1 UNL111111 0.1603 14 H 1.2803 -2.4243 -1.3291 H 1 UNL111111 0.1278 15 H 2.5279 -1.5070 -0.3972 H 1 UNL111111 0.1205 16 H 1.8154 2.7847 0.9175 H 1 UNL111111 0.1315 17 H 1.2662 1.3173 1.8058 H 1 UNL111111 0.1258 18 H -4.0236 -0.1358 1.8007 H 1 UNL111111 0.1532 19 H -4.4844 0.9144 0.4490 H 1 UNL111111 0.1562 20 H -4.9558 -0.7839 0.4533 H 1 UNL111111 0.1498 21 H 2.2111 -3.8038 0.6305 H 1 UNL111111 0.1480 22 H 1.6294 -2.5560 1.7544 H 1 UNL111111 0.1546 23 H 0.4712 -3.4942 0.8131 H 1 UNL111111 0.1550 24 H 3.8708 1.6380 1.6814 H 1 UNL111111 0.1445 25 H 3.2902 0.0556 1.1373 H 1 UNL111111 0.1511 26 H 3.7360 1.2852 -0.0509 H 1 UNL111111 0.1649 @BOND 1 5 2 2 2 14 7 1 3 12 6 1 4 2 4 1 5 2 3 1 6 2 1 1 7 15 7 1 8 4 8 1 9 7 3 1 10 7 10 1 11 26 11 1 12 6 13 1 13 6 1 1 14 6 9 1 15 19 9 1 16 20 9 1 17 21 10 1 18 9 18 1 19 10 23 1 20 10 22 1 21 16 8 1 22 8 11 1 23 8 17 1 24 11 25 1 25 11 24 1