0 mol 0 unq 0 iso 0 dist 7.65806 9.72725 6.0225 14.2251 10.4406 8.66548 13.3675 6.23948 8.73015 8.34244 numMergedOcc 0
1 mol 7 unq 0 iso 0 dist 8.41585 5.99459 6.88805 6.06176 6.36911 8.81608 10.3148 5.03847 5.5683 9.97624 numMergedOcc 0
2 mol 7 unq 1 iso 0 dist 7.10621 9.67164 13.156 10.515 9.36807 8.81608 8.72114 13.8829 5.5683 9.97624 numMergedOcc 0
3 mol 18 unq 0 iso 0 dist 9.51761 5.65084 12.6536 7.04695 12.3965 5.04478 15.3722 20.5374 11.0746 8.80193 numMergedOcc 0
4 mol 18 unq 1 iso 0 dist 7.3094 5.65084 9.36767 7.04695 12.8594 5.04478 15.3722 20.2871 11.0746 8.80193 numMergedOcc 0
5 mol 25 unq 0 iso 0 dist 5.04899 9.49421 13.6145 4.70708 9.43699 8.53931 9.01548 13.9331 5.38592 6.63839 numMergedOcc 0
6 mol 25 unq 1 iso 0 dist 7.57578 9.48085 5.18617 12.1492 12.8446 8.53931 13.8469 10.5328 5.38592 6.63839 numMergedOcc 0
7 mol 25 unq 2 iso 0 dist 7.17969 9.48085 5.68041 12.1492 11.7303 8.53931 13.8469 10.4337 5.38592 6.63839 numMergedOcc 0
8 mol 58 unq 0 iso 0 dist 6.64012 9.08221 4.00553 11.6697 10.5905 8.13051 9.86039 5.85698 5.45005 7.6481 numMergedOcc 0
9 mol 58 unq 1 iso 0 dist 9.4099 9.08221 8.55984 11.6697 15.9825 8.13051 9.86039 12.2123 5.45005 7.6481 numMergedOcc 0
10 mol 98 unq 0 iso 0 dist 5.08437 5.10496 3.9764 8.70415 10.417 6.61111 6.7117 7.06961 3.94967 6.0129 numMergedOcc 0
11 mol 98 unq 1 iso 0 dist 6.48948 5.92242 3.9764 9.74284 10.417 6.61111 9.42961 7.06961 3.94967 6.0129 numMergedOcc 0
12 mol 98 unq 2 iso 0 dist 6.10456 7.54889 10.4782 10.0962 10.417 4.44979 4.47349 7.06961 3.92737 6.0129 numMergedOcc 0
13 mol 98 unq 3 iso 0 dist 6.10456 5.2571 3.9764 10.0962 10.417 6.61111 4.47349 7.06961 3.94967 6.0129 numMergedOcc 0
14 mol 115 unq 0 iso 0 dist 7.30858 9.42082 15.3161 10.9739 17.6696 8.0168 17.0848 24.0778 10.3264 7.70313 numMergedOcc 0
15 mol 115 unq 1 iso 0 dist 9.33865 6.39384 6.63111 10.7942 7.76729 8.0168 13.3009 14.0688 10.3264 7.70313 numMergedOcc 0
16 mol 115 unq 2 iso 0 dist 9.33865 6.24825 6.95773 10.2377 7.64585 7.65255 12.125 6.40494 6.44969 7.52142 numMergedOcc 0
17 mol 115 unq 3 iso 0 dist 5.83991 9.42082 6.63111 10.9739 7.76729 8.0168 17.0848 14.0688 10.3264 7.70313 numMergedOcc 0
18 mol 115 unq 4 iso 0 dist 5.83991 6.24825 6.01673 10.2377 12.2309 7.65255 12.125 10.4285 6.44969 7.52142 numMergedOcc 0
19 mol 115 unq 5 iso 0 dist 6.11741 6.39384 6.07067 10.7942 12.9821 8.0168 13.3009 16.1804 10.3264 7.70313 numMergedOcc 0
20 mol 115 unq 6 iso 0 dist 7.88312 9.42082 6.07067 10.9739 12.9821 8.0168 17.0848 16.1804 10.3264 7.70313 numMergedOcc 0
21 mol 119 unq 0 iso 0 dist 8.73993 7.64052 9.68677 10.6679 9.63176 9.08536 17.9198 15.5019 14.9264 7.26955 numMergedOcc 0
22 mol 119 unq 1 iso 0 dist 9.87172 6.99446 6.20019 7.36192 7.44174 9.08536 14.2293 10.314 14.9264 7.26955 numMergedOcc 0
23 mol 119 unq 2 iso 0 dist 6.18601 8.95212 4.39676 16.7975 13.4411 9.08536 22.9076 18.9526 14.9264 7.26955 numMergedOcc 0
24 mol 133 unq 0 iso 0 dist 6.29155 8.77023 13.0405 9.53782 11.3058 8.55349 14.4764 17.9895 11.4316 7.41399 numMergedOcc 0
25 mol 133 unq 1 iso 0 dist 6.29155 8.77023 13.0405 9.53782 11.3058 8.55349 12.7901 16.6599 12.3375 8.21165 numMergedOcc 0
26 mol 133 unq 2 iso 0 dist 6.29155 8.77023 13.0405 9.53782 11.3058 8.55349 11.8524 16.3713 4.10674 8.97945 numMergedOcc 0
27 mol 133 unq 3 iso 0 dist 6.29155 8.77023 13.0405 9.53782 11.3058 8.55349 10.9581 12.131 6.24625 9.50664 numMergedOcc 0
28 mol 133 unq 4 iso 0 dist 6.29155 8.77023 13.0405 9.53782 11.3058 8.55349 12.5696 14.928 6.11861 6.71555 numMergedOcc 0
29 mol 133 unq 5 iso 0 dist 6.80239 8.77023 13.7612 9.53782 16.0613 8.55349 14.4764 21.2397 11.4316 7.41399 numMergedOcc 0
30 mol 133 unq 6 iso 0 dist 6.80239 8.77023 13.7612 9.53782 16.0613 8.55349 12.7901 19.3488 12.3375 8.21165 numMergedOcc 0
31 mol 133 unq 7 iso 0 dist 6.80239 8.77023 13.7612 9.53782 16.0613 8.55349 11.8524 17.4247 4.10674 8.97945 numMergedOcc 0
32 mol 133 unq 8 iso 0 dist 6.80239 8.77023 13.7612 9.53782 16.0613 8.55349 10.9581 14.8102 6.24625 9.50664 numMergedOcc 0
33 mol 133 unq 9 iso 0 dist 6.80239 8.77023 13.7612 9.53782 16.0613 8.55349 12.5696 18.2393 6.11861 6.71555 numMergedOcc 0
34 mol 133 unq 10 iso 0 dist 8.00618 8.77023 15.0115 9.53782 16.3407 8.55349 14.4764 19.1478 11.4316 7.41399 numMergedOcc 0
35 mol 133 unq 11 iso 0 dist 8.00618 8.77023 15.0115 9.53782 16.3407 8.55349 12.7901 16.0138 12.3375 8.21165 numMergedOcc 0
36 mol 133 unq 12 iso 0 dist 8.00618 8.77023 15.0115 9.53782 16.3407 8.55349 11.8524 17.3514 4.10674 8.97945 numMergedOcc 0
37 mol 133 unq 13 iso 0 dist 8.00618 8.77023 15.0115 9.53782 16.3407 8.55349 10.9581 18.5594 6.24625 9.50664 numMergedOcc 0
38 mol 133 unq 14 iso 0 dist 8.00618 8.77023 15.0115 9.53782 16.3407 8.55349 12.5696 19.7615 6.11861 6.71555 numMergedOcc 0
39 mol 134 unq 0 iso 0 dist 8.94367 9.33094 7.41373 5.3585 11.2292 7.43401 6.23142 4.57832 6.93712 8.55616 numMergedOcc 0
40 mol 134 unq 1 iso 0 dist 6.37586 9.33094 10.8635 5.3585 10.9613 7.43401 6.23142 5.29786 6.93712 8.55616 numMergedOcc 0
41 mol 134 unq 2 iso 0 dist 6.49416 9.33094 12.3479 5.3585 10.9685 7.43401 6.23142 5.71679 6.93712 8.55616 numMergedOcc 0
42 mol 134 unq 3 iso 0 dist 9.86662 9.1998 12.8086 6.74887 11.2292 6.44575 9.94764 4.57832 11.5269 8.55616 numMergedOcc 0
43 mol 134 unq 4 iso 0 dist 9.86662 8.69531 7.41373 6.74887 11.2292 7.43401 9.94764 4.57832 6.93712 8.55616 numMergedOcc 0
44 mol 134 unq 5 iso 0 dist 9.71307 9.1998 15.0225 6.74887 10.9613 6.44575 9.94764 5.29786 11.5269 8.55616 numMergedOcc 0
45 mol 134 unq 6 iso 0 dist 9.71307 8.69531 10.8635 6.74887 10.9613 7.43401 9.94764 5.29786 6.93712 8.55616 numMergedOcc 0
46 mol 143 unq 0 iso 0 dist 5.99315 7.36975 13.1926 6.01455 9.27292 7.05845 7.78652 6.48978 12.207 6.46089 numMergedOcc 0
47 mol 143 unq 1 iso 0 dist 5.99315 7.36975 13.1926 5.44503 9.93541 8.18023 9.14266 10.4028 13.1214 9.30424 numMergedOcc 0
48 mol 143 unq 2 iso 0 dist 5.99315 5.40637 7.39837 5.44503 9.93541 7.46803 9.14266 10.4028 4.06908 9.30424 numMergedOcc 0
49 mol 167 unq 0 iso 0 dist 9.87651 7.20495 7.87971 6.36909 15.1367 9.1326 9.67741 13.0123 5.43662 7.80054 numMergedOcc 0
50 mol 167 unq 1 iso 0 dist 9.87651 7.02548 11.6011 6.36909 15.1367 7.30954 9.67741 13.0123 5.95858 7.80054 numMergedOcc 0
51 mol 181 unq 0 iso 0 dist 7.81386 6.64173 6.8757 6.7991 4.93785 9.09234 5.94469 7.77758 4.98436 7.05653 numMergedOcc 0
52 mol 181 unq 1 iso 0 dist 7.81386 9.01624 5.71898 6.7991 4.93785 6.76746 5.94469 7.77758 11.9796 7.05653 numMergedOcc 0
53 mol 181 unq 2 iso 0 dist 7.81386 9.55105 5.83796 6.7991 4.93785 8.92098 5.94469 7.77758 12.3589 7.05653 numMergedOcc 0
54 mol 181 unq 3 iso 0 dist 7.63312 6.64173 10.6474 6.7991 10.1232 9.09234 5.94469 12.5387 4.98436 7.05653 numMergedOcc 0
55 mol 181 unq 4 iso 0 dist 7.63312 9.01624 5.93724 6.7991 10.1232 6.76746 5.94469 12.5387 11.9796 7.05653 numMergedOcc 0
56 mol 181 unq 5 iso 0 dist 7.63312 9.55105 5.12833 6.7991 10.1232 8.92098 5.94469 12.5387 12.3589 7.05653 numMergedOcc 0
57 mol 259 unq 0 iso 0 dist 7.46176 5.85442 10.067 5.79468 7.48005 6.23661 7.08526 8.81835 4.47425 8.71497 numMergedOcc 0
58 mol 259 unq 1 iso 0 dist 5.30224 8.03219 4.04513 5.31048 8.37865 8.84648 10.4552 8.75685 7.57379 8.71497 numMergedOcc 0
59 mol 259 unq 2 iso 0 dist 5.30224 6.9899 7.09907 5.31048 8.37865 6.23661 10.4552 8.75685 4.47425 8.71497 numMergedOcc 0
