0 mol 7 unq 0 iso 0 dist 9.67164 12.2041 5.99459 10.515 8.81608 6.06176 8.72114 5.5683 10.3148 9.97624 numMergedOcc 0
1 mol 7 unq 0 iso 1 dist 5.99459 12.2041 9.67164 6.06176 8.81608 10.515 10.3148 5.5683 8.72114 9.97624 numMergedOcc 0
2 mol 25 unq 0 iso 0 dist 9.48085 10.9391 9.49421 12.1492 8.53931 4.70708 13.8469 5.38592 9.01548 6.63839 numMergedOcc 0
3 mol 25 unq 0 iso 1 dist 9.49421 10.9391 9.48085 4.70708 8.53931 12.1492 9.01548 5.38592 13.8469 6.63839 numMergedOcc 0
4 mol 58 unq 0 iso 0 dist 9.97769 5.23069 9.32706 10.3598 8.13051 6.00578 12.9819 5.45005 11.3538 7.6481 numMergedOcc 0
5 mol 58 unq 0 iso 1 dist 9.32706 5.23069 9.97769 6.00578 8.13051 10.3598 11.3538 5.45005 12.9819 7.6481 numMergedOcc 0
6 mol 58 unq 1 iso 0 dist 9.97769 7.5247 9.08221 10.3598 8.13051 11.6697 12.9819 5.45005 9.86039 7.6481 numMergedOcc 0
7 mol 58 unq 1 iso 1 dist 9.08221 7.5247 9.97769 11.6697 8.13051 10.3598 9.86039 5.45005 12.9819 7.6481 numMergedOcc 0
8 mol 58 unq 1 iso 0 dist 9.32706 10.0658 9.08221 6.00578 8.13051 11.6697 11.3538 5.45005 9.86039 7.6481 numMergedOcc 0
9 mol 58 unq 1 iso 1 dist 9.08221 10.0658 9.32706 11.6697 8.13051 6.00578 9.86039 5.45005 11.3538 7.6481 numMergedOcc 0
10 mol 62 unq 0 iso 0 dist 9.69044 8.62608 6.9103 11.7069 9.1062 5.49555 7.56205 4.09232 4.74544 6.04903 numMergedOcc 0
11 mol 62 unq 0 iso 1 dist 6.9103 8.62608 9.69044 5.49555 9.1062 11.7069 4.74544 4.09232 7.56205 6.04903 numMergedOcc 0
12 mol 98 unq 0 iso 0 dist 5.10496 9.51923 5.92242 8.70415 6.61111 9.74284 6.7117 3.94967 9.42961 6.0129 numMergedOcc 0
13 mol 98 unq 0 iso 1 dist 5.92242 9.51923 5.10496 9.74284 6.61111 8.70415 9.42961 3.94967 6.7117 6.0129 numMergedOcc 0
14 mol 98 unq 1 iso 0 dist 5.10496 8.40073 5.2571 8.70415 6.61111 10.0962 6.7117 3.94967 4.47349 6.0129 numMergedOcc 0
15 mol 98 unq 1 iso 1 dist 5.2571 8.40073 5.10496 10.0962 6.61111 8.70415 4.47349 3.94967 6.7117 6.0129 numMergedOcc 0
16 mol 98 unq 2 iso 0 dist 5.10496 10.2427 8.7497 8.70415 6.61111 11.2452 6.7117 3.94967 5.65185 6.0129 numMergedOcc 0
17 mol 98 unq 2 iso 1 dist 8.7497 10.2427 5.10496 11.2452 6.61111 8.70415 5.65185 3.94967 6.7117 6.0129 numMergedOcc 0
18 mol 98 unq 3 iso 0 dist 9.64383 13.659 7.54889 12.0058 4.44979 10.0962 12.5931 3.92737 4.47349 6.0129 numMergedOcc 0
19 mol 98 unq 3 iso 1 dist 7.54889 13.659 9.64383 10.0962 4.44979 12.0058 4.47349 3.92737 12.5931 6.0129 numMergedOcc 0
20 mol 98 unq 4 iso 0 dist 9.64383 14.591 7.78931 12.0058 4.44979 11.2452 12.5931 3.92737 5.65185 6.0129 numMergedOcc 0
21 mol 98 unq 4 iso 1 dist 7.78931 14.591 9.64383 11.2452 4.44979 12.0058 5.65185 3.92737 12.5931 6.0129 numMergedOcc 0
22 mol 98 unq 1 iso 0 dist 5.92242 9.42358 5.2571 9.74284 6.61111 10.0962 9.42961 3.94967 4.47349 6.0129 numMergedOcc 0
23 mol 98 unq 1 iso 1 dist 5.2571 9.42358 5.92242 10.0962 6.61111 9.74284 4.47349 3.94967 9.42961 6.0129 numMergedOcc 0
24 mol 98 unq 2 iso 0 dist 5.92242 13.9786 8.7497 9.74284 6.61111 11.2452 9.42961 3.94967 5.65185 6.0129 numMergedOcc 0
25 mol 98 unq 2 iso 1 dist 8.7497 13.9786 5.92242 11.2452 6.61111 9.74284 5.65185 3.94967 9.42961 6.0129 numMergedOcc 0
26 mol 98 unq 4 iso 0 dist 7.54889 5.02887 7.78931 10.0962 4.44979 11.2452 4.47349 3.92737 5.65185 6.0129 numMergedOcc 0
27 mol 98 unq 4 iso 1 dist 7.78931 5.02887 7.54889 11.2452 4.44979 10.0962 5.65185 3.92737 4.47349 6.0129 numMergedOcc 0
28 mol 98 unq 2 iso 0 dist 5.2571 5.02887 8.7497 10.0962 6.61111 11.2452 4.47349 3.94967 5.65185 6.0129 numMergedOcc 0
29 mol 98 unq 2 iso 1 dist 8.7497 5.02887 5.2571 11.2452 6.61111 10.0962 5.65185 3.94967 4.47349 6.0129 numMergedOcc 0
30 mol 115 unq 0 iso 0 dist 6.39384 7.69052 9.42082 10.7942 8.0168 10.9739 13.3009 10.3264 17.0848 7.70313 numMergedOcc 0
31 mol 115 unq 0 iso 1 dist 9.42082 7.69052 6.39384 10.9739 8.0168 10.7942 17.0848 10.3264 13.3009 7.70313 numMergedOcc 0
32 mol 119 unq 0 iso 0 dist 8.95212 10.9871 6.99446 16.7975 9.08536 7.36192 22.9076 14.9264 14.2293 7.26955 numMergedOcc 0
33 mol 119 unq 0 iso 1 dist 6.99446 10.9871 8.95212 7.36192 9.08536 16.7975 14.2293 14.9264 22.9076 7.26955 numMergedOcc 0
34 mol 119 unq 1 iso 0 dist 8.95212 9.93257 7.64052 16.7975 9.08536 10.6679 22.9076 14.9264 17.9198 7.26955 numMergedOcc 0
35 mol 119 unq 1 iso 1 dist 7.64052 9.93257 8.95212 10.6679 9.08536 16.7975 17.9198 14.9264 22.9076 7.26955 numMergedOcc 0
36 mol 119 unq 1 iso 0 dist 6.99446 4.85907 7.64052 7.36192 9.08536 10.6679 14.2293 14.9264 17.9198 7.26955 numMergedOcc 0
37 mol 119 unq 1 iso 1 dist 7.64052 4.85907 6.99446 10.6679 9.08536 7.36192 17.9198 14.9264 14.2293 7.26955 numMergedOcc 0
38 mol 134 unq 0 iso 0 dist 9.10524 14.069 9.00918 14.0644 5.73203 5.9915 12.5366 4.07076 11.2937 6.21403 numMergedOcc 0
39 mol 134 unq 0 iso 1 dist 9.00918 14.069 9.10524 5.9915 5.73203 14.0644 11.2937 4.07076 12.5366 6.21403 numMergedOcc 0
40 mol 134 unq 1 iso 0 dist 6.42772 11.6064 9.1998 5.31077 6.44575 6.74887 12.1214 11.5269 9.94764 8.55616 numMergedOcc 0
41 mol 134 unq 1 iso 1 dist 9.1998 11.6064 6.42772 6.74887 6.44575 5.31077 9.94764 11.5269 12.1214 8.55616 numMergedOcc 0
42 mol 134 unq 2 iso 0 dist 6.42772 13.7309 8.70621 5.31077 6.44575 10.9715 12.1214 11.5269 15.049 8.55616 numMergedOcc 0
43 mol 134 unq 2 iso 1 dist 8.70621 13.7309 6.42772 10.9715 6.44575 5.31077 15.049 11.5269 12.1214 8.55616 numMergedOcc 0
44 mol 134 unq 3 iso 0 dist 9.33094 6.81259 8.69531 5.3585 7.43401 6.74887 6.23142 6.93712 9.94764 8.55616 numMergedOcc 0
45 mol 134 unq 3 iso 1 dist 8.69531 6.81259 9.33094 6.74887 7.43401 5.3585 9.94764 6.93712 6.23142 8.55616 numMergedOcc 0
46 mol 134 unq 2 iso 0 dist 9.1998 7.09823 8.70621 6.74887 6.44575 10.9715 9.94764 11.5269 15.049 8.55616 numMergedOcc 0
47 mol 134 unq 2 iso 1 dist 8.70621 7.09823 9.1998 10.9715 6.44575 6.74887 15.049 11.5269 9.94764 8.55616 numMergedOcc 0
48 mol 134 unq 4 iso 0 dist 5.35237 6.90348 7.99477 8.96357 6.57379 5.9915 11.2661 6.32315 11.2937 6.21403 numMergedOcc 0
49 mol 134 unq 4 iso 1 dist 7.99477 6.90348 5.35237 5.9915 6.57379 8.96357 11.2937 6.32315 11.2661 6.21403 numMergedOcc 0
50 mol 167 unq 0 iso 0 dist 6.84752 6.44246 7.86563 7.69326 7.30954 9.46955 11.6896 5.95858 12.8466 7.80054 numMergedOcc 0
51 mol 167 unq 0 iso 1 dist 7.86563 6.44246 6.84752 9.46955 7.30954 7.69326 12.8466 5.95858 11.6896 7.80054 numMergedOcc 0
52 mol 167 unq 1 iso 0 dist 6.84752 4.70068 7.02548 7.69326 7.30954 6.36909 11.6896 5.95858 9.67741 7.80054 numMergedOcc 0
53 mol 167 unq 1 iso 1 dist 7.02548 4.70068 6.84752 6.36909 7.30954 7.69326 9.67741 5.95858 11.6896 7.80054 numMergedOcc 0
54 mol 167 unq 1 iso 0 dist 7.86563 10.3445 7.02548 9.46955 7.30954 6.36909 12.8466 5.95858 9.67741 7.80054 numMergedOcc 0
55 mol 167 unq 1 iso 1 dist 7.02548 10.3445 7.86563 6.36909 7.30954 9.46955 9.67741 5.95858 12.8466 7.80054 numMergedOcc 0
56 mol 181 unq 0 iso 0 dist 9.01624 11.5866 5.05973 6.7991 6.76746 8.35755 5.94469 11.9796 14.8638 7.05653 numMergedOcc 0
57 mol 181 unq 0 iso 1 dist 5.05973 11.5866 9.01624 8.35755 6.76746 6.7991 14.8638 11.9796 5.94469 7.05653 numMergedOcc 0
58 mol 259 unq 0 iso 0 dist 5.85442 9.98105 6.9899 5.79468 6.23661 5.31048 7.08526 4.47425 10.4552 8.71497 numMergedOcc 0
59 mol 259 unq 0 iso 1 dist 6.9899 9.98105 5.85442 5.31048 6.23661 5.79468 10.4552 4.47425 7.08526 8.71497 numMergedOcc 0
60 mol 267 unq 0 iso 0 dist 8.8293 5.91646 7.34981 7.11419 5.08174 6.45566 13.8725 5.68457 10.2761 9.01354 numMergedOcc 0
61 mol 267 unq 0 iso 1 dist 7.34981 5.91646 8.8293 6.45566 5.08174 7.11419 10.2761 5.68457 13.8725 9.01354 numMergedOcc 0
62 mol 292 unq 0 iso 0 dist 9.9182 10.3106 7.30758 18.0293 8.73515 12.1551 19.2773 9.40023 14.0184 5.7131 numMergedOcc 0
63 mol 292 unq 0 iso 1 dist 7.30758 10.3106 9.9182 12.1551 8.73515 18.0293 14.0184 9.40023 19.2773 5.7131 numMergedOcc 0
64 mol 292 unq 1 iso 0 dist 9.9182 12.1693 9.10788 18.0293 8.73515 10.8709 19.2773 9.40023 14.6101 5.7131 numMergedOcc 0
65 mol 292 unq 1 iso 1 dist 9.10788 12.1693 9.9182 10.8709 8.73515 18.0293 14.6101 9.40023 19.2773 5.7131 numMergedOcc 0
66 mol 292 unq 1 iso 0 dist 7.30758 12.6861 9.10788 12.1551 8.73515 10.8709 14.0184 9.40023 14.6101 5.7131 numMergedOcc 0
67 mol 292 unq 1 iso 1 dist 9.10788 12.6861 7.30758 10.8709 8.73515 12.1551 14.6101 9.40023 14.0184 5.7131 numMergedOcc 0
