CD3CN, v8=2 2 1 1 7901.45690 1 B 0.0029217 0 DJ 0.111492 0 DJK 0.0000000209 0 HJ 0.000000572 0 HJK 0.00000234 0 HKJ 0.26054 0 nJ -0.00000162 0 nJJ -0.0000151 0 nJK 0.0000000000 0 nJJJ 0.0000000000 0 nJJK 0.0000000000 0 nJKK 0.07909 0 B3 -13.97 0 q¡ -0.000056 0 qj 0.0000000000 0 qjj 0.0000000000 0 qk 62184.00 0 Az 87556. 0 X 78900.000 0 A 0.6430000000 0 DK 0.0 0 nK 0.0000000000 0 HK .0000000000 0 B5J .0000000000 0 B5K .0000000000 0 B5l .0 0 12 -11 -2 205219.70 1. 12 -10 -2 205267.20 1. 12 -8 -2 205345.20 1. 12 -7 -2 205375.40 1. 12 -6 -2 200000.0 50000. 12 -5 -2 205418.40 1. 12 -4 -2 205432.10 1. 12 -3 -2 200000.0 50000. 12 -2 -2 205448.40 1. 12 -1 -2 205439.50 1. 12 0 -2 200000.0 50000. 12 1 -2 205430.60 1. 12 2 -2 205221.60 1. 12 3 -2 200000.0 50000. 12 4 -2 205310.40 1. 12 5 -2 205274.40 1. 12 6 -2 200000.0 50000. 12 7 -2 200000.0 50000. 12 8 -2 205125.60 1. 12 -8 0 200000.0 50000. 12 -7 0 200000.0 50000. 12 -6 0 205316.60 1. 12 -5 0 205357.90 1. 12 -4 0 200000.0 50000. 12 -3 0 205356.70 1. 12 -2 0 205384.30 1. 12 -1 0 200000.0 50000. 12 0 0 205399.90 1. 12 1 0 205396.30 1. 12 2 0 200000.0 50000. 12 3 0 200000.0 50000. 12 4 0 205524.00 1. 12 5 0 200000.0 50000. 12 6 0 200000.0 50000. 12 7 0 205275.80 1. 12 8 0 200000.0 50000. 12 9 0 200000.0 50000. 12 -8 2 200000.0 50000. 12 -7 2 200000.0 50000. 12 -6 2 205231.20 1. 12 -5 2 200000.0 50000. 12 -4 2 200000.0 50000. 12 -3 2 205334.20 1. 12 -2 2 200000.0 50000. 12 -1 2 200000.0 50000. 12 0 2 205433.30 1. 12 1 2 200000.0 50000. 12 2 2 205435.90 1. 12 3 2 205439.50 1. 12 4 2 200000.0 50000. 12 5 2 200000.0 50000. 12 6 2 205399.90 1. 12 7 2 200000.0 50000. 12 8 2 200000.0 50000. 12 9 2 205308.90 1. 1111 0 0 0.0 1.