0 mol 7 unq 0 iso 0 dist 6.36911 5.03847 9.97624 6.88805 8.81608 5.5683 10.6581 15.9584 6.02702 10.2465 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 6.36911 5.03847 9.97624 6.88805 8.81608 5.5683 10.5461 10.515 8.72114 9.67164 numMergedOcc 0
2 mol 7 unq 2 iso 0 dist 9.36807 13.8829 9.97624 13.156 8.81608 5.5683 18.3807 15.9584 6.02702 10.2465 numMergedOcc 0
3 mol 7 unq 3 iso 0 dist 9.36807 13.8829 9.97624 13.156 8.81608 5.5683 7.10621 10.515 8.72114 9.67164 numMergedOcc 0
4 mol 15 unq 0 iso 0 dist 9.29358 9.75966 6.50647 6.91314 9.51568 5.20798 11.3543 6.67334 6.42748 8.85174 numMergedOcc 0
5 mol 15 unq 1 iso 0 dist 9.29358 9.75966 6.50647 6.91314 9.51568 5.20798 9.88835 6.29685 7.48342 9.84471 numMergedOcc 0
6 mol 27 unq 0 iso 0 dist 9.77484 14.3929 7.60283 9.11842 6.78936 13.4461 17.0333 7.50515 9.52474 10.757 numMergedOcc 0
7 mol 45 unq 0 iso 0 dist 9.20119 10.7082 5.55096 12.466 5.81001 4.06745 11.5838 5.54436 9.53378 10.7109 numMergedOcc 0
8 mol 58 unq 0 iso 0 dist 8.81638 9.62267 7.6481 6.07871 8.13051 5.45005 18.1669 13.9007 8.80614 12.8149 numMergedOcc 0
9 mol 126 unq 0 iso 0 dist 7.75534 6.0268 7.36017 5.42561 8.7789 3.9234 6.06638 7.01257 6.30546 8.96947 numMergedOcc 0
10 mol 126 unq 1 iso 0 dist 7.75534 6.0268 7.36017 10.7549 9.93613 5.50104 6.06638 7.01257 6.30546 11.4624 numMergedOcc 0
11 mol 126 unq 2 iso 0 dist 7.75534 8.01268 5.14819 5.42561 8.7789 6.1079 12.1603 5.15767 6.29233 12.0971 numMergedOcc 0
12 mol 126 unq 3 iso 0 dist 7.75534 8.01268 5.14819 10.7549 9.93613 7.02562 12.1603 5.15767 6.29233 11.8923 numMergedOcc 0
13 mol 126 unq 4 iso 0 dist 7.75534 10.2072 6.84245 5.42561 8.7789 9.58426 12.1603 5.15767 5.42406 12.0971 numMergedOcc 0
14 mol 126 unq 5 iso 0 dist 7.75534 10.2072 6.84245 10.7549 9.93613 11.1195 12.1603 5.15767 5.42406 11.8923 numMergedOcc 0
15 mol 126 unq 6 iso 0 dist 9.06011 10.1326 7.36017 7.47528 8.7789 3.9234 12.1593 7.01257 6.30546 8.96947 numMergedOcc 0
16 mol 126 unq 7 iso 0 dist 9.06011 10.1326 7.36017 11.9496 9.93613 5.50104 12.1593 7.01257 6.30546 11.4624 numMergedOcc 0
17 mol 126 unq 8 iso 0 dist 9.06011 6.51507 5.14819 7.47528 8.7789 6.1079 10.4642 5.15767 6.29233 12.0971 numMergedOcc 0
18 mol 126 unq 9 iso 0 dist 9.06011 6.51507 5.14819 11.9496 9.93613 7.02562 10.4642 5.15767 6.29233 11.8923 numMergedOcc 0
19 mol 126 unq 10 iso 0 dist 9.06011 5.78149 6.84245 7.47528 8.7789 9.58426 10.4642 5.15767 5.42406 12.0971 numMergedOcc 0
20 mol 126 unq 11 iso 0 dist 9.06011 5.78149 6.84245 11.9496 9.93613 11.1195 10.4642 5.15767 5.42406 11.8923 numMergedOcc 0
21 mol 133 unq 0 iso 0 dist 7.92688 5.92062 6.51868 14.8533 9.10003 10.0161 7.11802 4.68409 9.22661 13.5288 numMergedOcc 0
22 mol 133 unq 1 iso 0 dist 7.92688 6.61891 7.34698 14.8533 9.10003 11.7838 7.11802 4.68409 7.56378 13.5288 numMergedOcc 0
23 mol 143 unq 0 iso 0 dist 7.31468 10.0059 6.46089 7.63293 7.05845 12.207 10.6877 6.01455 7.78652 7.36975 numMergedOcc 0
24 mol 143 unq 1 iso 0 dist 7.7056 8.57817 6.46089 11.903 7.05845 12.207 12.7524 6.01455 7.78652 7.36975 numMergedOcc 0
25 mol 181 unq 0 iso 0 dist 4.93785 7.77758 7.05653 6.8757 9.09234 4.98436 7.81386 6.7991 5.94469 6.64173 numMergedOcc 0
26 mol 181 unq 1 iso 0 dist 4.93785 7.77758 7.05653 5.71898 6.76746 11.9796 7.81386 6.7991 5.94469 9.01624 numMergedOcc 0
27 mol 181 unq 2 iso 0 dist 4.93785 7.77758 7.05653 5.83796 8.92098 12.3589 7.81386 6.7991 5.94469 9.55105 numMergedOcc 0
28 mol 227 unq 0 iso 0 dist 8.17891 10.9607 7.57454 4.1511 7.79951 12.8337 7.22101 6.43754 5.41321 9.91384 numMergedOcc 0
29 mol 227 unq 1 iso 0 dist 6.95902 9.72615 7.57454 4.69247 7.79951 12.8337 8.65997 6.43754 5.41321 9.91384 numMergedOcc 0
30 mol 234 unq 0 iso 0 dist 9.5707 10.0059 7.43663 3.95629 8.27411 11.1693 10.3625 5.9221 7.32499 8.84746 numMergedOcc 0
31 mol 234 unq 1 iso 0 dist 9.5707 10.0059 7.43663 15.9732 6.96257 10.7351 10.3625 5.9221 7.32499 11.1846 numMergedOcc 0
32 mol 238 unq 0 iso 0 dist 6.05141 10.7081 8.09718 5.27215 8.69525 15.3328 13.9668 13.171 7.57812 18.042 numMergedOcc 0
33 mol 238 unq 1 iso 0 dist 6.05141 10.7081 8.09718 5.27215 8.69525 15.3328 16.4238 11.9142 9.24557 19.192 numMergedOcc 0
34 mol 238 unq 2 iso 0 dist 6.05141 5.50308 6.73446 5.27215 8.69525 10.3346 13.9668 13.171 8.69104 18.042 numMergedOcc 0
35 mol 238 unq 3 iso 0 dist 8.09066 12.2874 8.09718 6.13368 8.69525 15.3328 12.8275 13.171 7.57812 18.042 numMergedOcc 0
36 mol 238 unq 4 iso 0 dist 8.09066 12.2874 8.09718 6.13368 8.69525 15.3328 15.1497 11.9142 9.24557 19.192 numMergedOcc 0
37 mol 238 unq 5 iso 0 dist 8.09066 7.11984 6.73446 6.13368 8.69525 10.3346 12.8275 13.171 8.69104 18.042 numMergedOcc 0
38 mol 238 unq 6 iso 0 dist 7.2766 10.4017 8.09718 10.0605 8.69525 15.3328 10.7456 13.171 7.57812 18.042 numMergedOcc 0
39 mol 238 unq 7 iso 0 dist 7.2766 10.4017 8.09718 10.0605 8.69525 15.3328 10.3007 11.9142 9.24557 19.192 numMergedOcc 0
40 mol 238 unq 8 iso 0 dist 7.2766 7.95232 6.73446 10.0605 8.69525 10.3346 10.7456 13.171 8.69104 18.042 numMergedOcc 0
41 mol 259 unq 0 iso 0 dist 7.48005 8.81835 8.71497 10.282 8.84648 7.57379 7.88519 11.6195 7.98231 14.2242 numMergedOcc 0
42 mol 259 unq 1 iso 0 dist 7.48005 8.81835 8.71497 10.282 8.84648 7.57379 7.46176 5.79468 7.08526 11.7465 numMergedOcc 0
43 mol 259 unq 2 iso 0 dist 7.48005 8.81835 8.71497 10.067 6.23661 4.47425 7.88519 11.6195 7.98231 10.3406 numMergedOcc 0
44 mol 259 unq 3 iso 0 dist 7.48005 8.81835 8.71497 10.067 6.23661 4.47425 7.46176 5.79468 7.08526 5.85442 numMergedOcc 0
45 mol 259 unq 4 iso 0 dist 8.37865 8.75685 8.71497 4.04513 8.84648 7.57379 15.9169 11.6195 7.98231 14.2242 numMergedOcc 0
46 mol 259 unq 5 iso 0 dist 8.37865 8.75685 8.71497 4.04513 8.84648 7.57379 11.858 5.79468 7.08526 11.7465 numMergedOcc 0
47 mol 259 unq 6 iso 0 dist 8.37865 8.75685 8.71497 7.09907 6.23661 4.47425 15.9169 11.6195 7.98231 10.3406 numMergedOcc 0
48 mol 259 unq 7 iso 0 dist 8.37865 8.75685 8.71497 7.09907 6.23661 4.47425 11.858 5.79468 7.08526 5.85442 numMergedOcc 0
