REMARK created by molecuilder on Sat Feb 12 16:48:42 2011, time step 0 ATOM 1 O01 0wat 01 0.000 0.000 0.000 0.00 0.00 O 0 ATOM 2 H01 0wat 01 0.759 0.000 0.504 0.00 0.00 H 0 ATOM 3 H02 0wat 01 0.759 0.000 -0.504 0.00 0.00 H 0 CONECT 1 2 3 CONECT 2 1 CONECT 3 1 END REMARK created by molecuilder on Sat Feb 12 16:48:42 2011, time step 1 ATOM 1 O01 0wat 01 0.000 0.000 0.000 0.00 0.00 O 0 ATOM 2 H01 0wat 01 0.759 0.088 0.496 0.00 0.00 H 0 ATOM 3 H02 0wat 01 0.759 -0.088 -0.496 0.00 0.00 H 0 CONECT 1 2 3 CONECT 2 1 CONECT 3 1 END REMARK created by molecuilder on Sat Feb 12 16:48:42 2011, time step 2 ATOM 1 O01 0wat 01 0.000 0.000 0.000 0.00 0.00 O 0 ATOM 2 H01 0wat 01 0.759 0.173 0.473 0.00 0.00 H 0 ATOM 3 H02 0wat 01 0.759 -0.173 -0.473 0.00 0.00 H 0 CONECT 1 2 3 CONECT 2 1 CONECT 3 1 END REMARK created by molecuilder on Sat Feb 12 16:48:42 2011, time step 3 ATOM 1 O01 0wat 01 0.000 0.000 0.000 0.00 0.00 O 0 ATOM 2 H01 0wat 01 0.759 0.253 0.436 0.00 0.00 H 0 ATOM 3 H02 0wat 01 0.759 -0.253 -0.436 0.00 0.00 H 0 CONECT 1 2 3 CONECT 2 1 CONECT 3 1 END REMARK created by molecuilder on Sat Feb 12 16:48:42 2011, time step 4 ATOM 1 O01 0wat 01 0.000 0.000 0.000 0.00 0.00 O 0 ATOM 2 H01 0wat 01 0.759 0.325 0.385 0.00 0.00 H 0 ATOM 3 H02 0wat 01 0.759 -0.325 -0.385 0.00 0.00 H 0 CONECT 1 2 3 CONECT 2 1 CONECT 3 1 END REMARK created by molecuilder on Sat Feb 12 16:48:42 2011, time step 5 ATOM 1 O01 0wat 01 0.000 0.000 0.000 0.00 0.00 O 0 ATOM 2 H01 0wat 01 0.759 0.387 0.323 0.00 0.00 H 0 ATOM 3 H02 0wat 01 0.759 -0.387 -0.323 0.00 0.00 H 0 CONECT 1 2 3 CONECT 2 1 CONECT 3 1 END REMARK created by molecuilder on Sat Feb 12 16:48:42 2011, time step 6 ATOM 1 O01 0wat 01 0.000 0.000 0.000 0.00 0.00 O 0 ATOM 2 H01 0wat 01 0.759 0.437 0.251 0.00 0.00 H 0 ATOM 3 H02 0wat 01 0.759 -0.437 -0.251 0.00 0.00 H 0 CONECT 1 2 3 CONECT 2 1 CONECT 3 1 END REMARK created by molecuilder on Sat Feb 12 16:48:42 2011, time step 7 ATOM 1 O01 0wat 01 0.000 0.000 0.000 0.00 0.00 O 0 ATOM 2 H01 0wat 01 0.759 0.474 0.171 0.00 0.00 H 0 ATOM 3 H02 0wat 01 0.759 -0.474 -0.171 0.00 0.00 H 0 CONECT 1 2 3 CONECT 2 1 CONECT 3 1 END REMARK created by molecuilder on Sat Feb 12 16:48:42 2011, time step 8 ATOM 1 O01 0wat 01 0.000 0.000 0.000 0.00 0.00 O 0 ATOM 2 H01 0wat 01 0.759 0.496 0.086 0.00 0.00 H 0 ATOM 3 H02 0wat 01 0.759 -0.496 -0.086 0.00 0.00 H 0 CONECT 1 2 3 CONECT 2 1 CONECT 3 1 END REMARK created by molecuilder on Sat Feb 12 16:48:42 2011, time step 9 ATOM 1 O01 0wat 01 0.000 0.000 0.000 0.00 0.00 O 0 ATOM 2 H01 0wat 01 0.759 0.503 -0.001 0.00 0.00 H 0 ATOM 3 H02 0wat 01 0.759 -0.503 0.001 0.00 0.00 H 0 CONECT 1 2 3 CONECT 2 1 CONECT 3 1 END REMARK created by molecuilder on Sat Feb 12 16:48:42 2011, time step 10 ATOM 1 O01 0wat 01 0.000 0.000 0.000 0.00 0.00 O 0 ATOM 2 H01 0wat 01 0.759 0.495 -0.088 0.00 0.00 H 0 ATOM 3 H02 0wat 01 0.759 -0.495 0.088 0.00 0.00 H 0 CONECT 1 2 3 CONECT 2 1 CONECT 3 1 END REMARK created by molecuilder on Sat Feb 12 16:48:42 2011, time step 11 ATOM 1 O01 0wat 01 0.000 0.000 0.000 0.00 0.00 O 0 ATOM 2 H01 0wat 01 0.759 0.472 -0.173 0.00 0.00 H 0 ATOM 3 H02 0wat 01 0.759 -0.472 0.173 0.00 0.00 H 0 CONECT 1 2 3 CONECT 2 1 CONECT 3 1 END REMARK created by molecuilder on Sat Feb 12 16:48:42 2011, time step 12 ATOM 1 O01 0wat 01 0.000 0.000 0.000 0.00 0.00 O 0 ATOM 2 H01 0wat 01 0.759 0.435 -0.252 0.00 0.00 H 0 ATOM 3 H02 0wat 01 0.759 -0.435 0.252 0.00 0.00 H 0 CONECT 1 2 3 CONECT 2 1 CONECT 3 1 END REMARK created by molecuilder on Sat Feb 12 16:48:42 2011, time step 13 ATOM 1 O01 0wat 01 0.000 0.000 0.000 0.00 0.00 O 0 ATOM 2 H01 0wat 01 0.759 0.385 -0.324 0.00 0.00 H 0 ATOM 3 H02 0wat 01 0.759 -0.385 0.324 0.00 0.00 H 0 CONECT 1 2 3 CONECT 2 1 CONECT 3 1 END REMARK created by molecuilder on Sat Feb 12 16:48:42 2011, time step 14 ATOM 1 O01 0wat 01 0.000 0.000 0.000 0.00 0.00 O 0 ATOM 2 H01 0wat 01 0.759 0.323 -0.386 0.00 0.00 H 0 ATOM 3 H02 0wat 01 0.759 -0.323 0.386 0.00 0.00 H 0 CONECT 1 2 3 CONECT 2 1 CONECT 3 1 END REMARK created by molecuilder on Sat Feb 12 16:48:42 2011, time step 15 ATOM 1 O01 0wat 01 0.000 0.000 0.000 0.00 0.00 O 0 ATOM 2 H01 0wat 01 0.759 0.251 -0.436 0.00 0.00 H 0 ATOM 3 H02 0wat 01 0.759 -0.251 0.436 0.00 0.00 H 0 CONECT 1 2 3 CONECT 2 1 CONECT 3 1 END REMARK created by molecuilder on Sat Feb 12 16:48:42 2011, time step 16 ATOM 1 O01 0wat 01 0.000 0.000 0.000 0.00 0.00 O 0 ATOM 2 H01 0wat 01 0.759 0.171 -0.473 0.00 0.00 H 0 ATOM 3 H02 0wat 01 0.759 -0.171 0.473 0.00 0.00 H 0 CONECT 1 2 3 CONECT 2 1 CONECT 3 1 END REMARK created by molecuilder on Sat Feb 12 16:48:42 2011, time step 17 ATOM 1 O01 0wat 01 0.000 0.000 0.000 0.00 0.00 O 0 ATOM 2 H01 0wat 01 0.759 0.086 -0.496 0.00 0.00 H 0 ATOM 3 H02 0wat 01 0.759 -0.086 0.496 0.00 0.00 H 0 CONECT 1 2 3 CONECT 2 1 CONECT 3 1 END REMARK created by molecuilder on Sat Feb 12 16:48:42 2011, time step 18 ATOM 1 O01 0wat 01 0.000 0.000 0.000 0.00 0.00 O 0 ATOM 2 H01 0wat 01 0.759 -0.001 -0.503 0.00 0.00 H 0 ATOM 3 H02 0wat 01 0.759 0.001 0.503 0.00 0.00 H 0 CONECT 1 2 3 CONECT 2 1 CONECT 3 1 END REMARK created by molecuilder on Sat Feb 12 16:48:42 2011, time step 19 ATOM 1 O01 0wat 01 0.000 0.000 0.000 0.00 0.00 O 0 ATOM 2 H01 0wat 01 0.759 -0.088 -0.495 0.00 0.00 H 0 ATOM 3 H02 0wat 01 0.759 0.088 0.495 0.00 0.00 H 0 CONECT 1 2 3 CONECT 2 1 CONECT 3 1 END REMARK created by molecuilder on Sat Feb 12 16:48:42 2011, time step 20 ATOM 1 O01 0wat 01 0.000 0.000 0.000 0.00 0.00 O 0 ATOM 2 H01 0wat 01 0.759 -0.173 -0.472 0.00 0.00 H 0 ATOM 3 H02 0wat 01 0.759 0.173 0.472 0.00 0.00 H 0 CONECT 1 2 3 CONECT 2 1 CONECT 3 1 END REMARK created by molecuilder on Sat Feb 12 16:48:42 2011, time step 21 ATOM 1 O01 0wat 01 0.000 0.000 0.000 0.00 0.00 O 0 ATOM 2 H01 0wat 01 0.759 -0.252 -0.435 0.00 0.00 H 0 ATOM 3 H02 0wat 01 0.759 0.252 0.435 0.00 0.00 H 0 CONECT 1 2 3 CONECT 2 1 CONECT 3 1 END REMARK created by molecuilder on Sat Feb 12 16:48:42 2011, time step 22 ATOM 1 O01 0wat 01 0.000 0.000 0.000 0.00 0.00 O 0 ATOM 2 H01 0wat 01 0.759 -0.324 -0.385 0.00 0.00 H 0 ATOM 3 H02 0wat 01 0.759 0.324 0.385 0.00 0.00 H 0 CONECT 1 2 3 CONECT 2 1 CONECT 3 1 END REMARK created by molecuilder on Sat Feb 12 16:48:42 2011, time step 23 ATOM 1 O01 0wat 01 0.000 0.000 0.000 0.00 0.00 O 0 ATOM 2 H01 0wat 01 0.759 -0.386 -0.323 0.00 0.00 H 0 ATOM 3 H02 0wat 01 0.759 0.386 0.323 0.00 0.00 H 0 CONECT 1 2 3 CONECT 2 1 CONECT 3 1 END REMARK created by molecuilder on Sat Feb 12 16:48:42 2011, time step 24 ATOM 1 O01 0wat 01 0.000 0.000 0.000 0.00 0.00 O 0 ATOM 2 H01 0wat 01 0.759 -0.436 -0.251 0.00 0.00 H 0 ATOM 3 H02 0wat 01 0.759 0.436 0.251 0.00 0.00 H 0 CONECT 1 2 3 CONECT 2 1 CONECT 3 1 END REMARK created by molecuilder on Sat Feb 12 16:48:42 2011, time step 25 ATOM 1 O01 0wat 01 0.000 0.000 0.000 0.00 0.00 O 0 ATOM 2 H01 0wat 01 0.759 -0.473 -0.171 0.00 0.00 H 0 ATOM 3 H02 0wat 01 0.759 0.473 0.171 0.00 0.00 H 0 CONECT 1 2 3 CONECT 2 1 CONECT 3 1 END REMARK created by molecuilder on Sat Feb 12 16:48:42 2011, time step 26 ATOM 1 O01 0wat 01 0.000 0.000 0.000 0.00 0.00 O 0 ATOM 2 H01 0wat 01 0.759 -0.496 -0.086 0.00 0.00 H 0 ATOM 3 H02 0wat 01 0.759 0.496 0.086 0.00 0.00 H 0 CONECT 1 2 3 CONECT 2 1 CONECT 3 1 END REMARK created by molecuilder on Sat Feb 12 16:48:42 2011, time step 27 ATOM 1 O01 0wat 01 0.000 0.000 0.000 0.00 0.00 O 0 ATOM 2 H01 0wat 01 0.759 -0.503 0.001 0.00 0.00 H 0 ATOM 3 H02 0wat 01 0.759 0.503 -0.001 0.00 0.00 H 0 CONECT 1 2 3 CONECT 2 1 CONECT 3 1 END REMARK created by molecuilder on Sat Feb 12 16:48:42 2011, time step 28 ATOM 1 O01 0wat 01 0.000 0.000 0.000 0.00 0.00 O 0 ATOM 2 H01 0wat 01 0.759 -0.495 0.088 0.00 0.00 H 0 ATOM 3 H02 0wat 01 0.759 0.495 -0.088 0.00 0.00 H 0 CONECT 1 2 3 CONECT 2 1 CONECT 3 1 END REMARK created by molecuilder on Sat Feb 12 16:48:42 2011, time step 29 ATOM 1 O01 0wat 01 0.000 0.000 0.000 0.00 0.00 O 0 ATOM 2 H01 0wat 01 0.759 -0.472 0.173 0.00 0.00 H 0 ATOM 3 H02 0wat 01 0.759 0.472 -0.173 0.00 0.00 H 0 CONECT 1 2 3 CONECT 2 1 CONECT 3 1 END REMARK created by molecuilder on Sat Feb 12 16:48:42 2011, time step 30 ATOM 1 O01 0wat 01 0.000 0.000 0.000 0.00 0.00 O 0 ATOM 2 H01 0wat 01 0.759 -0.435 0.252 0.00 0.00 H 0 ATOM 3 H02 0wat 01 0.759 0.435 -0.252 0.00 0.00 H 0 CONECT 1 2 3 CONECT 2 1 CONECT 3 1 END REMARK created by molecuilder on Sat Feb 12 16:48:42 2011, time step 31 ATOM 1 O01 0wat 01 0.000 0.000 0.000 0.00 0.00 O 0 ATOM 2 H01 0wat 01 0.759 -0.385 0.324 0.00 0.00 H 0 ATOM 3 H02 0wat 01 0.759 0.385 -0.324 0.00 0.00 H 0 CONECT 1 2 3 CONECT 2 1 CONECT 3 1 END REMARK created by molecuilder on Sat Feb 12 16:48:42 2011, time step 32 ATOM 1 O01 0wat 01 0.000 0.000 0.000 0.00 0.00 O 0 ATOM 2 H01 0wat 01 0.759 -0.323 0.386 0.00 0.00 H 0 ATOM 3 H02 0wat 01 0.759 0.323 -0.386 0.00 0.00 H 0 CONECT 1 2 3 CONECT 2 1 CONECT 3 1 END REMARK created by molecuilder on Sat Feb 12 16:48:42 2011, time step 33 ATOM 1 O01 0wat 01 0.000 0.000 0.000 0.00 0.00 O 0 ATOM 2 H01 0wat 01 0.759 -0.251 0.436 0.00 0.00 H 0 ATOM 3 H02 0wat 01 0.759 0.251 -0.436 0.00 0.00 H 0 CONECT 1 2 3 CONECT 2 1 CONECT 3 1 END REMARK created by molecuilder on Sat Feb 12 16:48:42 2011, time step 34 ATOM 1 O01 0wat 01 0.000 0.000 0.000 0.00 0.00 O 0 ATOM 2 H01 0wat 01 0.759 -0.171 0.473 0.00 0.00 H 0 ATOM 3 H02 0wat 01 0.759 0.171 -0.473 0.00 0.00 H 0 CONECT 1 2 3 CONECT 2 1 CONECT 3 1 END REMARK created by molecuilder on Sat Feb 12 16:48:42 2011, time step 35 ATOM 1 O01 0wat 01 0.000 0.000 0.000 0.00 0.00 O 0 ATOM 2 H01 0wat 01 0.759 -0.086 0.496 0.00 0.00 H 0 ATOM 3 H02 0wat 01 0.759 0.086 -0.496 0.00 0.00 H 0 CONECT 1 2 3 CONECT 2 1 CONECT 3 1 END