# Total Energy along IRC
# X-Axis:  Intrinsic Reaction Coordinate
# Y-Axis:  Total Energy (Hartree)
#                  X                   Y
        0.0000000000     -231.6193223090
        0.3143900000     -231.6205511540
        0.6286600000     -231.6239752650
        0.9429300000     -231.6289704350
        1.2571800000     -231.6348384240
        1.5714100000     -231.6409914000
        1.8856200000     -231.6469995490
        2.1997800000     -231.6525741970
        2.5138300000     -231.6575502170
        2.8277800000     -231.6618817170
        3.1417100000     -231.6656236810
        3.4557700000     -231.6688760190
        3.7699600000     -231.6717268620
        4.0842300000     -231.6742371540
        4.3985400000     -231.6764503300
        4.7128600000     -231.6784012190
        5.0271900000     -231.6801198140
        5.3415200000     -231.6816327400
        5.6558500000     -231.6829639090
        5.9701800000     -231.6841347700
        6.2845200000     -231.6851643110
        6.5988600000     -231.6860689710
        6.9132000000     -231.6868626180
        7.2275600000     -231.6875567160
        7.5419200000     -231.6881607190
        7.8562800000     -231.6886826260
        8.1706300000     -231.6891295940
        8.4849600000     -231.6895084820
        8.7992600000     -231.6898262710
        9.1134900000     -231.6900903430
        9.4276500000     -231.6903086080
        9.7417300000     -231.6904894070
       10.0557600000     -231.6906410850
       10.3698200000     -231.6907712360
       10.6839700000     -231.6908859740
       10.9982000000     -231.6909896460
       11.3125000000     -231.6910850440
       11.6268200000     -231.6911738110
       11.9411600000     -231.6912567900
       12.2555000000     -231.6913342390
       12.5698400000     -231.6914059480
       12.8841800000     -231.6914713250
       13.1985200000     -231.6915294550
       13.5128600000     -231.6915791580