0 mol 19 unq 0 iso 0 dist 8.18518 14.1404 8.4674 6.57145 4.54938 7.67038 10.5195 6.41575 4.64838 4.97119 numMergedOcc 0
1 mol 19 unq 0 iso 1 dist 8.18518 6.57145 4.54938 14.1404 8.4674 7.67038 10.5195 6.41575 4.97119 4.64838 numMergedOcc 0
2 mol 19 unq 1 iso 0 dist 8.18518 14.1404 8.4674 6.01189 7.82074 10.3915 10.5195 6.41575 4.64838 6.01808 numMergedOcc 0
3 mol 19 unq 1 iso 1 dist 8.18518 6.01189 7.82074 14.1404 8.4674 10.3915 10.5195 6.41575 6.01808 4.64838 numMergedOcc 0
4 mol 19 unq 1 iso 0 dist 8.18518 6.57145 4.54938 6.01189 7.82074 5.03957 10.5195 6.41575 4.97119 6.01808 numMergedOcc 0
5 mol 19 unq 1 iso 1 dist 8.18518 6.01189 7.82074 6.57145 4.54938 5.03957 10.5195 6.41575 6.01808 4.97119 numMergedOcc 0
6 mol 59 unq 0 iso 0 dist 6.46655 8.94845 7.17396 6.32263 9.21998 6.05545 7.02802 8.08618 6.90592 7.6021 numMergedOcc 0
7 mol 59 unq 0 iso 1 dist 6.46655 6.32263 9.21998 8.94845 7.17396 6.05545 7.02802 8.08618 7.6021 6.90592 numMergedOcc 0
8 mol 95 unq 0 iso 0 dist 8.26838 4.33346 9.03572 7.47119 8.83255 6.59319 9.61054 9.49454 13.3662 12.0666 numMergedOcc 0
9 mol 95 unq 0 iso 1 dist 8.26838 7.47119 8.83255 4.33346 9.03572 6.59319 9.61054 9.49454 12.0666 13.3662 numMergedOcc 0
10 mol 95 unq 1 iso 0 dist 8.26838 4.33346 9.03572 15.4217 8.03644 16.6055 9.61054 9.49454 13.3662 11.4333 numMergedOcc 0
11 mol 95 unq 1 iso 1 dist 8.26838 15.4217 8.03644 4.33346 9.03572 16.6055 9.61054 9.49454 11.4333 13.3662 numMergedOcc 0
12 mol 95 unq 1 iso 0 dist 8.26838 7.47119 8.83255 15.4217 8.03644 13.8105 9.61054 9.49454 12.0666 11.4333 numMergedOcc 0
13 mol 95 unq 1 iso 1 dist 8.26838 15.4217 8.03644 7.47119 8.83255 13.8105 9.61054 9.49454 11.4333 12.0666 numMergedOcc 0
14 mol 133 unq 0 iso 0 dist 7.15203 5.38237 7.24514 9.71227 8.22656 6.65743 5.86611 7.71248 4.34568 10.6025 numMergedOcc 0
15 mol 133 unq 0 iso 1 dist 7.15203 9.71227 8.22656 5.38237 7.24514 6.65743 5.86611 7.71248 10.6025 4.34568 numMergedOcc 0
16 mol 134 unq 0 iso 0 dist 7.97208 12.5576 6.54501 9.52819 6.49416 5.00526 15.4716 7.80532 7.41674 9.87376 numMergedOcc 0
17 mol 134 unq 0 iso 1 dist 7.97208 9.52819 6.49416 12.5576 6.54501 5.00526 15.4716 7.80532 9.87376 7.41674 numMergedOcc 0
18 mol 204 unq 0 iso 0 dist 7.7292 13.4646 7.10633 9.54287 8.51516 10.8344 16.5925 9.68728 7.67571 10.8573 numMergedOcc 0
19 mol 204 unq 0 iso 1 dist 7.7292 9.54287 8.51516 13.4646 7.10633 10.8344 16.5925 9.68728 10.8573 7.67571 numMergedOcc 0
20 mol 206 unq 0 iso 0 dist 7.10166 5.15743 8.02137 13.609 9.774 10.4 14.2366 7.75885 12.7604 6.45859 numMergedOcc 0
21 mol 206 unq 0 iso 1 dist 7.10166 13.609 9.774 5.15743 8.02137 10.4 14.2366 7.75885 6.45859 12.7604 numMergedOcc 0
22 mol 206 unq 1 iso 0 dist 9.66896 15.7773 8.02137 12.0196 9.774 10.4 5.91675 7.75885 12.7604 6.45859 numMergedOcc 0
23 mol 206 unq 1 iso 1 dist 9.66896 12.0196 9.774 15.7773 8.02137 10.4 5.91675 7.75885 6.45859 12.7604 numMergedOcc 0
24 mol 222 unq 0 iso 0 dist 8.69148 6.52189 8.01589 5.33282 7.7699 10.4579 8.56453 7.67576 10.3151 7.81022 numMergedOcc 0
25 mol 222 unq 0 iso 1 dist 8.69148 5.33282 7.7699 6.52189 8.01589 10.4579 8.56453 7.67576 7.81022 10.3151 numMergedOcc 0
26 mol 222 unq 1 iso 0 dist 8.69148 6.52189 8.01589 5.33282 7.7699 10.4579 13.6076 9.82371 8.52017 15.7504 numMergedOcc 0
27 mol 222 unq 1 iso 1 dist 8.69148 5.33282 7.7699 6.52189 8.01589 10.4579 13.6076 9.82371 15.7504 8.52017 numMergedOcc 0
28 mol 222 unq 2 iso 0 dist 8.69148 6.52189 8.01589 9.97859 7.21333 13.3522 8.56453 7.67576 10.3151 7.75656 numMergedOcc 0
29 mol 222 unq 2 iso 1 dist 8.69148 9.97859 7.21333 6.52189 8.01589 13.3522 8.56453 7.67576 7.75656 10.3151 numMergedOcc 0
30 mol 222 unq 3 iso 0 dist 8.69148 6.52189 8.01589 9.97859 7.21333 13.3522 13.6076 9.82371 8.52017 16.0949 numMergedOcc 0
31 mol 222 unq 3 iso 1 dist 8.69148 9.97859 7.21333 6.52189 8.01589 13.3522 13.6076 9.82371 16.0949 8.52017 numMergedOcc 0
32 mol 222 unq 2 iso 0 dist 8.69148 5.33282 7.7699 9.97859 7.21333 5.24516 8.56453 7.67576 7.81022 7.75656 numMergedOcc 0
33 mol 222 unq 2 iso 1 dist 8.69148 9.97859 7.21333 5.33282 7.7699 5.24516 8.56453 7.67576 7.75656 7.81022 numMergedOcc 0
34 mol 222 unq 3 iso 0 dist 8.69148 5.33282 7.7699 9.97859 7.21333 5.24516 13.6076 9.82371 15.7504 16.0949 numMergedOcc 0
35 mol 222 unq 3 iso 1 dist 8.69148 9.97859 7.21333 5.33282 7.7699 5.24516 13.6076 9.82371 16.0949 15.7504 numMergedOcc 0
36 mol 222 unq 4 iso 0 dist 7.27481 5.68063 6.00706 5.90074 7.54212 6.8425 13.0565 9.07471 7.75466 13.3447 numMergedOcc 0
37 mol 222 unq 4 iso 1 dist 7.27481 5.90074 7.54212 5.68063 6.00706 6.8425 13.0565 9.07471 13.3447 7.75466 numMergedOcc 0
38 mol 223 unq 0 iso 0 dist 9.94212 11.4946 8.77153 13.1422 8.6166 8.51421 10.5593 7.48463 11.8654 6.05524 numMergedOcc 0
39 mol 223 unq 0 iso 1 dist 9.94212 13.1422 8.6166 11.4946 8.77153 8.51421 10.5593 7.48463 6.05524 11.8654 numMergedOcc 0
40 mol 224 unq 0 iso 0 dist 7.04127 11.7724 9.40098 4.55824 6.61986 9.54151 13.4507 9.51597 4.98993 12.4692 numMergedOcc 0
41 mol 224 unq 0 iso 1 dist 7.04127 4.55824 6.61986 11.7724 9.40098 9.54151 13.4507 9.51597 12.4692 4.98993 numMergedOcc 0
42 mol 231 unq 0 iso 0 dist 9.98232 10.9863 7.37839 10.2117 8.40182 4.06055 11.1156 7.79066 9.0443 12.1512 numMergedOcc 0
43 mol 231 unq 0 iso 1 dist 9.98232 10.2117 8.40182 10.9863 7.37839 4.06055 11.1156 7.79066 12.1512 9.0443 numMergedOcc 0
44 mol 259 unq 0 iso 0 dist 6.96379 10.908 8.13497 12.7595 7.88519 4.69778 7.39099 7.98231 8.41846 8.81835 numMergedOcc 0
45 mol 259 unq 0 iso 1 dist 6.96379 12.7595 7.88519 10.908 8.13497 4.69778 7.39099 7.98231 8.81835 8.41846 numMergedOcc 0
