@MOLECULE (2R,3R)-2,3-bis(2,2-dimethylbutyl)oxirane 43 43 0 0 0 SMALL USER_CHARGES @ATOM 1 C 5.7526 -0.3374 -0.3889 C.3 1 UNL11111111 -0.4330 2 C 4.3262 -0.3735 -0.9363 C.3 1 UNL11111111 -0.2788 3 C 3.2340 -0.1043 0.1312 C.3 1 UNL11111111 0.1185 4 C 3.2817 -1.1923 1.2133 C.3 1 UNL11111111 -0.4654 5 C 3.4300 1.2797 0.7615 C.3 1 UNL11111111 -0.4634 6 C 1.8683 -0.1504 -0.6034 C.3 1 UNL11111111 -0.3346 7 C 0.6905 0.1474 0.2864 C.3 1 UNL11111111 0.0085 8 H 0.8310 -0.0344 1.3554 H 1 UNL11111111 0.1520 9 O -0.0059 1.3667 -0.0005 O.3 1 UNL11111111 -0.3711 10 C -0.6891 0.1409 -0.2908 C.3 1 UNL11111111 0.0082 11 H -0.8271 -0.0400 -1.3602 H 1 UNL11111111 0.1519 12 C -1.8646 -0.1731 0.5963 C.3 1 UNL11111111 -0.3345 13 C -3.2334 -0.1056 -0.1315 C.3 1 UNL11111111 0.1187 14 C -3.4275 1.2922 -0.7312 C.3 1 UNL11111111 -0.4634 15 C -3.2886 -1.1693 -1.2372 C.3 1 UNL11111111 -0.4654 16 C -4.3223 -0.3920 0.9349 C.3 1 UNL11111111 -0.2788 17 C -5.7511 -0.3366 0.3952 C.3 1 UNL11111111 -0.4330 18 H 5.9128 -1.1026 0.3783 H 1 UNL11111111 0.1410 19 H 6.4818 -0.5177 -1.1868 H 1 UNL11111111 0.1373 20 H 5.9890 0.6345 0.0583 H 1 UNL11111111 0.1453 21 H 4.2307 0.3723 -1.7493 H 1 UNL11111111 0.1363 22 H 4.1402 -1.3583 -1.4056 H 1 UNL11111111 0.1327 23 H 4.2576 -1.2137 1.7108 H 1 UNL11111111 0.1477 24 H 2.5315 -1.0242 1.9922 H 1 UNL11111111 0.1426 25 H 3.1065 -2.1859 0.7891 H 1 UNL11111111 0.1429 26 H 3.5204 2.0573 -0.0052 H 1 UNL11111111 0.1489 27 H 2.5815 1.5574 1.3977 H 1 UNL11111111 0.1517 28 H 4.3297 1.3165 1.3831 H 1 UNL11111111 0.1445 29 H 1.8844 0.5785 -1.4417 H 1 UNL11111111 0.1628 30 H 1.7359 -1.1469 -1.0688 H 1 UNL11111111 0.1482 31 H -1.7332 -1.1811 1.0368 H 1 UNL11111111 0.1483 32 H -1.8756 0.5363 1.4511 H 1 UNL11111111 0.1624 33 H -2.5790 1.5818 -1.3622 H 1 UNL11111111 0.1520 34 H -4.3280 1.3443 -1.3506 H 1 UNL11111111 0.1445 35 H -3.5152 2.0532 0.0522 H 1 UNL11111111 0.1488 36 H -3.1133 -2.1725 -0.8361 H 1 UNL11111111 0.1429 37 H -4.2666 -1.1776 -1.7308 H 1 UNL11111111 0.1477 38 H -2.5415 -0.9851 -2.0154 H 1 UNL11111111 0.1427 39 H -4.1398 -1.3873 1.3824 H 1 UNL11111111 0.1326 40 H -4.2192 0.3362 1.7628 H 1 UNL11111111 0.1363 41 H -5.9849 0.6464 -0.0289 H 1 UNL11111111 0.1453 42 H -5.9187 -1.0835 -0.3881 H 1 UNL11111111 0.1410 43 H -6.4777 -0.5309 1.1923 H 1 UNL11111111 0.1372 @BOND 1 1 2 1 2 2 3 1 3 3 4 1 4 3 5 1 5 3 6 1 6 6 7 1 7 7 8 1 8 7 9 1 9 9 10 1 10 10 11 1 11 7 10 1 12 10 12 1 13 12 13 1 14 13 14 1 15 13 15 1 16 13 16 1 17 16 17 1 18 1 18 1 19 1 19 1 20 1 20 1 21 2 21 1 22 2 22 1 23 4 23 1 24 4 24 1 25 4 25 1 26 5 26 1 27 5 27 1 28 5 28 1 29 6 29 1 30 6 30 1 31 12 31 1 32 12 32 1 33 14 33 1 34 14 34 1 35 14 35 1 36 15 36 1 37 15 37 1 38 15 38 1 39 16 39 1 40 16 40 1 41 17 41 1 42 17 42 1 43 17 43 1