@MOLECULE delipid 48 47 0 0 0 SMALL GASTEIGER @ATOM 1 S -6.6614 0.7655 0.7420 S.3 1 UNL1111111111 -0.0562 2 S 6.5505 -0.1579 -1.1222 S.3 1 UNL1111111111 -0.0565 3 O -7.8589 0.5986 -2.4128 O.3 1 UNL1111111111 -0.5465 4 O 5.7017 2.7953 0.1802 O.3 1 UNL1111111111 -0.5465 5 C -0.1919 -0.7892 0.9294 C.3 1 UNL1111111111 -0.2718 6 C 0.9957 -0.7863 -0.0421 C.3 1 UNL1111111111 -0.2687 7 C -1.4634 -0.2919 0.2306 C.3 1 UNL1111111111 -0.2705 8 C 2.2705 -1.2499 0.6743 C.3 1 UNL1111111111 -0.2740 9 C -2.6488 -0.2997 1.2035 C.3 1 UNL1111111111 -0.2733 10 C 3.4750 -1.2207 -0.2763 C.3 1 UNL1111111111 -0.2691 11 C -3.9207 0.2144 0.5128 C.3 1 UNL1111111111 -0.2712 12 C 4.7436 -1.6572 0.4684 C.3 1 UNL1111111111 -0.2711 13 C -5.0985 0.1537 1.4790 C.3 1 UNL1111111111 -0.3147 14 C 5.9581 -1.7580 -0.4468 C.3 1 UNL1111111111 -0.3149 15 C -7.1041 -0.5775 -0.4299 C.3 1 UNL1111111111 -0.3804 16 C 7.0459 0.7827 0.3746 C.3 1 UNL1111111111 -0.3807 17 C -8.2857 -0.1470 -1.2939 C.3 1 UNL1111111111 0.0165 18 C 7.0114 2.2805 0.0845 C.3 1 UNL1111111111 0.0168 19 H -0.3517 -1.8076 1.3294 H 1 UNL1111111111 0.1350 20 H 0.0334 -0.1506 1.8042 H 1 UNL1111111111 0.1383 21 H 0.7831 -1.4429 -0.9058 H 1 UNL1111111111 0.1359 22 H 1.1419 0.2277 -0.4594 H 1 UNL1111111111 0.1398 23 H -1.3034 0.7286 -0.1655 H 1 UNL1111111111 0.1399 24 H -1.6869 -0.9269 -0.6470 H 1 UNL1111111111 0.1379 25 H 2.4657 -0.6019 1.5493 H 1 UNL1111111111 0.1385 26 H 2.1277 -2.2702 1.0755 H 1 UNL1111111111 0.1356 27 H -2.8114 -1.3232 1.5898 H 1 UNL1111111111 0.1365 28 H -2.4173 0.3259 2.0860 H 1 UNL1111111111 0.1392 29 H 3.2925 -1.8816 -1.1437 H 1 UNL1111111111 0.1394 30 H 3.5986 -0.2040 -0.6941 H 1 UNL1111111111 0.1472 31 H -4.1159 -0.3866 -0.3966 H 1 UNL1111111111 0.1411 32 H -3.7560 1.2512 0.1552 H 1 UNL1111111111 0.1520 33 H 4.5678 -2.6488 0.9384 H 1 UNL1111111111 0.1438 34 H 4.9355 -0.9709 1.3167 H 1 UNL1111111111 0.1410 35 H -4.9117 0.7953 2.3636 H 1 UNL1111111111 0.1661 36 H -5.2409 -0.8717 1.8643 H 1 UNL1111111111 0.1537 37 H 6.7928 -2.2620 0.0735 H 1 UNL1111111111 0.1523 38 H 5.7255 -2.3802 -1.3351 H 1 UNL1111111111 0.1673 39 H -7.3454 -1.4962 0.1325 H 1 UNL1111111111 0.1603 40 H -6.2397 -0.8192 -1.0784 H 1 UNL1111111111 0.1727 41 H 8.0568 0.4674 0.6869 H 1 UNL1111111111 0.1615 42 H 6.3659 0.5539 1.2182 H 1 UNL1111111111 0.1723 43 H -8.7713 -1.0253 -1.7701 H 1 UNL1111111111 0.1446 44 H -9.0558 0.4248 -0.7441 H 1 UNL1111111111 0.1275 45 H 7.5461 2.8510 0.8733 H 1 UNL1111111111 0.1442 46 H 7.4397 2.5514 -0.8988 H 1 UNL1111111111 0.1267 47 H -7.4168 1.4274 -2.1378 H 1 UNL1111111111 0.3210 48 H 5.1075 2.3734 -0.4736 H 1 UNL1111111111 0.3215 @BOND 1 1 13 1 2 1 15 1 3 2 14 1 4 2 16 1 5 3 17 1 6 3 47 1 7 4 18 1 8 4 48 1 9 5 6 1 10 5 7 1 11 5 19 1 12 5 20 1 13 6 8 1 14 6 21 1 15 6 22 1 16 7 9 1 17 7 23 1 18 7 24 1 19 8 10 1 20 8 25 1 21 8 26 1 22 9 11 1 23 9 27 1 24 9 28 1 25 10 12 1 26 10 29 1 27 10 30 1 28 11 13 1 29 11 31 1 30 11 32 1 31 12 14 1 32 12 33 1 33 12 34 1 34 13 35 1 35 13 36 1 36 14 37 1 37 14 38 1 38 15 17 1 39 15 39 1 40 15 40 1 41 16 18 1 42 16 41 1 43 16 42 1 44 17 43 1 45 17 44 1 46 18 45 1 47 18 46 1